Version2.4
2021-05-29T04:40:35Z
10.1021/jm300687e
Gaussian16
RevisionB.01
PWARBURT
05-Nov-2020
#N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2)
DUDE CCOc1ccc(cc1C)C(=O)C2=C(C(=O)N([C@@H]2c3ccc(cc3)OCC=C)CCCO)[O-] C40048825
RHF
6-31G(d)
(6D,7F)
CCOc1ccc(cc1C)C(=O)C2=C(C(=O)N([C@@H]2c3ccc(cc3)OCC=C)CCCO)[O-]
C01[X(C26H28N1O6)]
177
C1
551
OCCCN1[C@H](c2ccc(cc2)OCC=C)C(=C(C1=O)[O-])C(=O)c1ccc(c(c1)C)OCC
OCCCN1[C@H](c2ccc(cc2)OCC=C)C(=C(C1=O)[O-])C(=O)c1ccc(c(c1)C)OCC
CCOc1ccc(cc1C)C(=O)C2=C([O-])C(=O)N(CCCO)[C@@H]2c3ccc(OCC=C)cc3
InChIKey=BYOMKFXJSIUXMI-HSZRJFAPSA-M
InChI=1S/C26H29NO6/c1-4-15-33-20-10-7-18(8-11-20)23-22(25(30)26(31)27(23)13-6-14-28)24(29)19-9-12-21(32-5-2)17(3)16-19/h4,7-12,16,23,28,30H,1,5-6,13-15H2,2-3H3/p-1/t23-/m1/s1
InChI=1/C26H29NO6/c1-4-15-33-20-10-7-18(8-11-20)23-22(25(30)26(31)27(23)13-6-14-28)24(29)19-9-12-21(32-5-2)17(3)16-19/h4,7-12,16,23,28,30H,1,5-6,13-15H2,2-3H3/p-1/t23-/m1/s1/fC26H28NO6/h30h/q-1
CCOc1ccc(cc1C)C(=O)C2=C(C(=O)N([C@@H]2c3ccc(cc3)OCC=C)CCCO)[O-]
C01[X(C26H28N1O6)]
177
C01
551
OCCCN1[C@H](c2ccc(cc2)OCC=C)C(=C(C1=O)[O-])C(=O)c1ccc(c(c1)C)OCC
OCCCN1[C@H]([C]2[CH][CH][C]([CH][CH]2)OCC=C)[C]([C](=O)C1=O)[C](=O)[C]1[CH][CH][C]([C]([CH]1)C)OCC
CCO[C]1[CH][CH][C]([CH][C]1C)C(=O)[C]2[C@@H]([C]3[CH][CH][C]([CH][CH]3)OCC=C)N(CCCO)C(=O)C2=O
InChIKey=RATAKNDSJCPIEX-HSZRJFAPSA-N
InChI=1S/C26H28NO6/c1-4-15-33-20-10-7-18(8-11-20)23-22(25(30)26(31)27(23)13-6-14-28)24(29)19-9-12-21(32-5-2)17(3)16-19/h4,7-12,16,23,28H,1,5-6,13-15H2,2-3H3/t23-/m1/s1
InChI=1/C26H28NO6/c1-4-15-33-20-10-7-18(8-11-20)23-22(25(30)26(31)27(23)13-6-14-28)24(29)19-9-12-21(32-5-2)17(3)16-19/h4,7-12,16,23,28H,1,5-6,13-15H2,2-3H3/t23-/m1/s1
3315.3118614620
-1504.4904476
1-A
18259.4232
120
431
551
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10.02214
9.4243 -7.4245 -14.0337
18.4631
|XX|YY|ZZ|XY|XZ|YZ|
-252.3007 -204.1430 -238.6736 20.8983 33.2548 -28.8411
|XX|YY|ZZ|XY|XZ|YZ|
-20.5949 27.5627 -6.9678 20.8983 33.2548 -28.8411
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ|
151.9380 -29.7782 -232.3742 40.3555 -86.5925 -173.3997 69.2401 -104.3716 -25.0134 -7.1404
|XXXX|YYYY|ZZZZ|XXXY|XXXZ|YYYX|YYYZ|ZZZX|ZZZY|XXYY|XXZZ|YYZZ|XXYZ|YYXZ|ZZXY|
-12405.9587 -9053.2887 -4265.2896 333.3657 881.5311 -57.8830 -148.3381 572.7108 -303.8242 -3501.1442 -2530.6612 -2310.1915 -123.7180 -68.3249 231.9979
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|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|
11.4509 17.7878 20.0489 24.8760 29.5920 38.8382 45.7624 51.3035 58.1785 72.2524 80.4577 80.9843 97.3022 111.2110 118.9184 120.5667 129.1543 132.3864 150.8765 157.8683 169.4330 189.0837 204.7730 210.2470 219.6560 241.6604 272.8812 278.3301 279.3467 288.6595 310.8161 333.4075 340.5511 340.8741 367.8214 377.4559 390.1642 416.7908 432.2209 464.3277 471.1491 494.1285 499.8135 531.7432 533.5136 547.7293 585.3080 591.1808 603.5999 631.9868 649.8141 657.7208 695.3984 712.4110 719.2713 757.3241 803.6950 805.7456 812.2837 840.6222 849.4615 861.7991 876.6183 892.3571 898.7886 914.3610 921.5554 928.0135 939.0340 942.8758 958.3912 972.9800 1016.5130 1019.7064 1036.3280 1069.5740 1073.0039 1079.0076 1081.7199 1089.4823 1097.6990 1098.2537 1108.9887 1111.4769 1124.9469 1148.4690 1156.1392 1172.5434 1174.0338 1186.7492 1193.6937 1202.1607 1221.1740 1241.1714 1254.0249 1272.7309 1275.5182 1285.0348 1298.5683 1301.7626 1306.3064 1311.0856 1321.6634 1328.0697 1345.8980 1357.5145 1379.2643 1395.7140 1397.8878 1400.4243 1408.3666 1429.7963 1430.8170 1432.6331 1438.0925 1441.9186 1447.9650 1485.4506 1505.1891 1530.5635 1538.3370 1542.7715 1559.1387 1562.1478 1572.7440 1584.4972 1590.0457 1606.6777 1607.6186 1613.9557 1628.8905 1630.1849 1637.7936 1638.6049 1646.0649 1648.4749 1668.6028 1674.4501 1682.2145 1689.9635 1693.0488 1778.4060 1780.4399 1804.9040 1817.0613 1819.2536 1885.4528 1939.8346 1958.7871 3161.4884 3176.3251 3187.3233 3189.0533 3193.2461 3202.3066 3209.8006 3221.1924 3222.5121 3229.1457 3238.5967 3251.2156 3266.5590 3272.0962 3277.6271 3288.6055 3288.7602 3325.5758 3351.2077 3353.6463 3372.3767 3379.0884 3381.1577 3384.1047 3393.9721 3397.6119 3404.8336 4114.4724
4.9893 5.1272 5.3667 4.5141 3.7808 3.8230 4.8967 6.8543 5.4089 2.0139 3.8680 3.7454 8.1902 1.7157 2.7888 4.2615 3.3717 3.5649 1.9606 2.0472 2.7001 4.7743 5.1359 4.4530 3.4139 4.1844 4.7492 1.8052 2.1890 1.1322 5.2427 4.9848 3.6433 3.6970 3.7868 7.5175 5.3193 5.6291 3.5870 3.3242 5.0546 3.1938 4.0772 2.9843 5.1399 4.8263 4.9617 7.2276 2.9906 3.8808 4.7053 5.0455 6.1346 2.2118 4.7932 3.5928 4.0650 5.2462 1.2783 3.4144 4.2606 3.9820 4.9352 4.1845 1.2763 4.6465 1.2746 3.2982 1.5416 2.0205 1.5628 3.9541 2.3460 1.5000 1.5068 1.5655 1.3503 1.7498 1.8648 1.3855 1.7042 1.4606 2.5052 2.7023 3.4618 1.2813 3.1266 2.4489 1.7202 3.9542 2.4491 3.3161 2.8010 1.9716 2.4691 2.8153 2.4225 2.0176 1.5598 1.5228 2.0331 2.5951 1.7331 2.0963 1.5203 2.9290 2.4249 1.1346 3.7347 1.8269 4.4575 1.1129 1.3547 1.3327 1.3512 1.1227 1.3538 1.5447 1.4728 2.8227 1.2660 1.2469 1.7426 1.4533 1.9502 1.4070 2.2581 2.6249 1.4770 1.4385 1.0446 1.0440 1.1593 1.1579 1.0549 1.1307 1.1495 1.6902 1.0915 1.3908 2.2804 7.1347 6.2264 11.1415 5.9636 5.5611 4.3836 12.7694 11.9669 1.0593 1.0832 1.0613 1.1040 1.0545 1.0367 1.0393 1.0640 1.0674 1.1088 1.1028 1.1019 1.0981 1.1011 1.1028 1.1049 1.1039 1.0603 1.0954 1.0891 1.0888 1.0889 1.0947 1.0915 1.0940 1.0944 1.1160 1.0668
0.0004 0.0010 0.0013 0.0016 0.0020 0.0034 0.0060 0.0106 0.0108 0.0062 0.0148 0.0145 0.0457 0.0125 0.0232 0.0365 0.0331 0.0368 0.0263 0.0301 0.0457 0.1006 0.1269 0.1160 0.0970 0.1440 0.2084 0.0824 0.1006 0.0556 0.2984 0.3265 0.2490 0.2531 0.3019 0.6310 0.4771 0.5761 0.3948 0.4223 0.6611 0.4594 0.6001 0.4972 0.8620 0.8531 1.0015 1.4883 0.6420 0.9133 1.1706 1.2860 1.7478 0.6614 1.4610 1.2141 1.5470 2.0067 0.4969 1.4216 1.8114 1.7425 2.2345 1.9632 0.6075 2.2888 0.6378 1.6735 0.8009 1.0583 0.8458 2.2055 1.4283 0.9189 0.9535 1.0552 0.9160 1.2003 1.2856 0.9689 1.2098 1.0380 1.8153 1.9669 2.5812 0.9958 2.4623 1.9837 1.3970 3.2812 2.0561 2.8236 2.4611 1.7895 2.2877 2.6869 2.3222 1.9630 1.5497 1.5204 2.0441 2.6283 1.7837 2.1784 1.6225 3.1802 2.7179 1.3023 4.2999 2.1110 5.2093 1.3405 1.6340 1.6116 1.6464 1.3753 1.6723 2.0083 1.9659 3.8960 1.7652 1.7485 2.4959 2.0896 2.8421 2.0812 3.3637 3.9923 2.2490 2.2077 1.6330 1.6346 1.8321 1.8318 1.6840 1.8104 1.8856 2.7922 1.8199 2.3403 3.8512 13.2949 11.6291 21.3846 11.6010 10.8442 9.1815 28.3106 27.0525 6.2384 6.4387 6.3526 6.6153 6.3353 6.2639 6.3087 6.5046 6.5310 6.8120 6.8148 6.8628 6.9038 6.9461 6.9799 7.0404 7.0348 6.9090 7.2479 7.2169 7.2958 7.3258 7.3736 7.3647 7.4247 7.4437 7.6224 10.6408
0.5578 1.3132 0.6029 0.4213 0.0068 0.3712 0.9502 1.6474 5.1094 8.3161 4.0061 0.3438 0.7906 2.6243 0.7461 0.7399 2.0049 2.3721 1.3919 0.7148 0.9722 0.3219 2.6508 1.0883 2.5024 5.0319 4.2965 1.8047 0.8037 119.6549 2.2783 4.4651 1.6191 2.2467 1.9304 6.5421 2.8810 1.8536 1.2965 1.0621 9.3653 7.5332 9.8501 0.7978 6.2502 6.1384 9.1487 31.2662 12.7245 25.9223 33.7143 10.3867 5.5677 1.7986 20.4585 6.5142 8.9246 13.0422 1.1904 43.4869 27.2451 24.2543 15.9893 23.5247 3.6712 27.4316 0.0305 25.0278 32.3715 18.0798 17.0430 1.9074 5.8535 3.6102 6.3156 1.3236 54.5629 12.8417 5.2107 0.8483 12.1284 7.6199 1.6161 2.5849 18.5241 9.8322 5.5463 15.9560 3.8232 109.0683 17.6438 66.8754 55.9172 9.9243 5.9631 8.0164 115.8610 9.9313 29.4474 5.7031 27.5477 24.1405 29.6802 75.4734 79.7920 52.3655 159.5106 11.9569 513.7024 25.1305 372.1767 1.6581 26.5403 11.7990 5.1600 6.1448 31.1505 88.3563 14.5390 742.2283 65.7528 9.4126 77.5823 39.5767 34.8937 71.1420 39.5103 382.7092 84.4255 22.8577 0.0409 5.6873 20.5230 8.8098 2.0103 4.6741 26.2557 68.4847 5.5803 11.0085 127.0066 28.1798 24.9443 317.8694 160.1695 69.0374 3.3474 709.9359 636.4944 62.6348 56.2406 33.4185 62.5887 30.1504 52.6272 43.1478 18.2205 62.7732 40.5658 36.5310 37.1152 14.1663 53.5604 27.9255 55.5016 51.8242 19.5344 8.2550 19.5477 16.4707 14.1580 19.4944 10.1438 21.3263 16.7886 30.1643 31.2722
1.9910 0.9837 0.9081 0.6510 3.9574 2.6055 1.7997 1.9399 4.0433 0.6170 2.2077 3.7072 1.0459 0.0617 2.6142 1.8678 0.4277 1.4369 1.7359 1.8247 1.1436 0.1573 1.6076 0.3988 3.2144 0.6290 3.8728 1.3911 0.5298 4.8382 1.1612 2.6431 2.1868 0.7520 3.9048 2.0052 4.0591 2.3910 1.7386 0.4150 1.5575 0.7197 0.6412 1.6956 1.7506 3.0307 5.9484 0.1998 0.5037 1.9990 3.6130 1.5837 3.2811 13.9490 5.9723 0.3421 1.9543 1.6255 1.0053 8.6595 9.4402 5.2260 1.7550 15.3958 1.1100 2.4963 2.3142 16.1564 1.2343 4.3129 0.7177 4.3691 4.6247 5.9395 2.5137 1.7896 1.6999 1.5164 2.5612 0.6831 6.8587 3.8500 3.6937 0.7622 9.3842 6.1211 0.6441 10.2114 4.4536 10.7006 3.2361 2.1994 2.1927 0.6883 6.4951 1.1861 4.8962 4.9090 15.8110 1.2665 3.1154 6.4897 4.1567 2.9641 3.6134 9.0189 47.0834 14.9326 16.5107 0.2935 20.4851 14.6236 1.4051 21.8554 3.8093 23.5847 0.9268 9.2494 3.9012 26.7190 7.2510 0.9755 5.2734 3.3170 15.1281 4.2202 2.0296 8.7046 20.4685 4.0950 25.0615 15.9336 23.9588 8.0086 18.5475 5.2626 5.8862 8.0654 8.5198 2.4159 1.1919 11.0477 6.4058 72.8357 66.1173 58.2614 43.5893 65.3778 44.9780 61.1258 27.2865 73.0931 75.4851 36.5405 128.3313 170.3829 127.6373 8.7433 59.4960 27.6958 82.1330 54.0662 77.2115 63.1823 35.4507 21.6432 71.4369 101.1456 36.9806 38.3562 31.0475 101.7938 35.7561 114.2650 98.8703 94.1154 169.3641
0.7219 0.7499 0.7054 0.7495 0.7441 0.7460 0.7412 0.7116 0.7483 0.7464 0.7428 0.7193 0.6971 0.4199 0.7371 0.7082 0.7488 0.7435 0.7031 0.7470 0.6013 0.7009 0.2453 0.7491 0.6419 0.5173 0.1270 0.1446 0.2777 0.6663 0.7484 0.1319 0.3318 0.4571 0.7489 0.1994 0.7476 0.7428 0.7500 0.7008 0.7063 0.5971 0.7490 0.3093 0.6434 0.4421 0.3085 0.6258 0.6775 0.6957 0.5015 0.6665 0.7500 0.7377 0.1064 0.6405 0.1888 0.6807 0.6959 0.0952 0.2345 0.5031 0.2008 0.0374 0.2293 0.1102 0.7013 0.1863 0.3643 0.4760 0.3919 0.3588 0.6765 0.2988 0.5775 0.7392 0.5758 0.6749 0.7486 0.2479 0.2104 0.1995 0.5352 0.2607 0.1502 0.4530 0.3083 0.3074 0.4042 0.6601 0.4447 0.7458 0.2337 0.7499 0.7499 0.6684 0.1288 0.2189 0.0925 0.7325 0.4297 0.0645 0.3362 0.5008 0.7379 0.3140 0.2952 0.7458 0.2198 0.7180 0.1445 0.7374 0.7500 0.4318 0.5299 0.7409 0.2564 0.7284 0.6549 0.4450 0.3727 0.6941 0.7125 0.5789 0.4440 0.7026 0.4907 0.5799 0.3852 0.7465 0.7499 0.7356 0.5025 0.7088 0.6972 0.6721 0.6252 0.4975 0.7487 0.7470 0.3033 0.7081 0.5804 0.4986 0.5833 0.4570 0.2172 0.2809 0.3149 0.1074 0.2799 0.0890 0.5788 0.3178 0.0344 0.0187 0.0642 0.7500 0.7490 0.6455 0.7315 0.7476 0.7443 0.7492 0.7494 0.3717 0.1589 0.2672 0.5923 0.6667 0.6457 0.2395 0.3212 0.1448 0.1385 0.5566 0.3196
0.8385 0.8571 0.8273 0.8568 0.8533 0.8545 0.8514 0.8315 0.8560 0.8548 0.8524 0.8368 0.8215 0.5915 0.8486 0.8292 0.8564 0.8529 0.8257 0.8552 0.7510 0.8241 0.3939 0.8565 0.7819 0.6818 0.2254 0.2527 0.4347 0.7997 0.8561 0.2330 0.4983 0.6274 0.8564 0.3324 0.8556 0.8524 0.8571 0.8241 0.8279 0.7477 0.8565 0.4725 0.7830 0.6131 0.4715 0.7698 0.8077 0.8205 0.6680 0.7999 0.8571 0.8491 0.1924 0.7809 0.3177 0.8100 0.8207 0.1738 0.3799 0.6694 0.3345 0.0720 0.3731 0.1985 0.8244 0.3141 0.5340 0.6449 0.5631 0.5281 0.8070 0.4601 0.7322 0.8501 0.7308 0.8059 0.8562 0.3974 0.3477 0.3326 0.6973 0.4136 0.2612 0.6236 0.4714 0.4702 0.5757 0.7952 0.6157 0.8544 0.3788 0.8571 0.8571 0.8012 0.2282 0.3592 0.1694 0.8456 0.6012 0.1211 0.5032 0.6674 0.8492 0.4780 0.4558 0.8544 0.3604 0.8359 0.2526 0.8488 0.8571 0.6032 0.6927 0.8512 0.4081 0.8429 0.7915 0.6160 0.5430 0.8194 0.8321 0.7333 0.6149 0.8253 0.6584 0.7341 0.5561 0.8549 0.8571 0.8477 0.6689 0.8296 0.8216 0.8039 0.7694 0.6644 0.8563 0.8552 0.4654 0.8291 0.7345 0.6655 0.7368 0.6274 0.3569 0.4386 0.4790 0.1940 0.4374 0.1634 0.7332 0.4823 0.0665 0.0368 0.1207 0.8571 0.8565 0.7846 0.8450 0.8556 0.8534 0.8566 0.8568 0.5420 0.2742 0.4217 0.7439 0.8000 0.7847 0.3865 0.4862 0.2529 0.2434 0.7151 0.4844
298.150
1.00000
1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61
6 6 8 6 6 6 6 6 6 6 6 8 6 6 6 8 7 6 1 6 6 6 6 6 6 8 6 6 6 6 6 6 8 8 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 15.99491 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783
17221.4125 20408.9359 27187.9569
0.99944 0.03170 0.01092 -0.03136 0.99907 -0.02953 -0.01185 0.02917 0.99950
1
0.00503 0.00424 0.00319
0.10480 0.08843 0.06638
16.48 25.59 28.85 35.79 42.58 55.88 65.84 73.81 83.71 103.96 115.76 116.52 140.00 160.01 171.10 173.47 185.82 190.47 217.08 227.14 243.78 272.05 294.62 302.50 316.04 347.70 392.62 400.45 401.92 415.32 447.20 479.70 489.98 490.44 529.21 543.07 561.36 599.67 621.87 668.06 677.88 710.94 719.12 765.06 767.61 788.06 842.13 850.58 868.45 909.29 934.94 946.31 1000.52 1025.00 1034.87 1089.62 1156.34 1159.29 1168.70 1209.47 1222.19 1239.94 1261.26 1283.90 1293.16 1315.56 1325.91 1335.20 1351.06 1356.59 1378.91 1399.90 1462.54 1467.13 1491.04 1538.88 1543.81 1552.45 1556.35 1567.52 1579.34 1580.14 1595.59 1599.17 1618.55 1652.39 1663.43 1687.03 1689.17 1707.47 1717.46 1729.64 1757.00 1785.77 1804.26 1831.18 1835.19 1848.88 1868.35 1872.95 1879.48 1886.36 1901.58 1910.80 1936.45 1953.16 1984.45 2008.12 2011.25 2014.90 2026.33 2057.16 2058.63 2061.24 2069.09 2074.60 2083.30 2137.23 2165.63 2202.14 2213.32 2219.70 2243.25 2247.58 2262.83 2279.74 2287.72 2311.65 2313.00 2322.12 2343.61 2345.47 2356.42 2357.59 2368.32 2371.79 2400.75 2409.16 2420.33 2431.48 2435.92 2558.73 2561.66 2596.85 2614.35 2617.50 2712.75 2790.99 2818.26 4548.68 4570.02 4585.85 4588.34 4594.37 4607.40 4618.19 4634.58 4636.48 4646.02 4659.62 4677.77 4699.85 4707.82 4715.77 4731.57 4731.79 4784.76 4821.64 4825.15 4852.10 4861.75 4864.73 4868.97 4883.17 4888.41 4898.80 5919.81
0.532176
0.563447
0.564392
0.463813
-1503.958271
-1503.927000
-1503.926056
-1504.026635
3.373436D-04
MUNgauss
RevisionA2.1
retrievium
29-May-2021
DUDE CCOc1ccc(cc1C)C(=O)C2=C(C(=O)N([C@@H]2c3ccc(cc3)OCC=C)CCCO)[O-] C40048825
RHF
6-31G(d)
(6D,10F)
C1
450.191663
|X|Y|Z|
82.138420 92.199140 54.879881
74.626910
18
|36.858105|
|12.561839|36.858105|
|8.096567|13.628256|73.516695|
|5.219227|7.973151|24.882796|36.858105|
|4.408177|6.723435|13.987873|13.798046|36.858105|
|3.338978|4.508324|9.218416|7.938495|13.670941|36.858105|
|2.968197|3.776445|8.156709|6.820481|7.887934|13.815874|36.858105|
|3.201851|3.991346|9.415505|7.985232|6.921593|8.017149|13.648326|36.858105|
|4.080290|5.239810|14.496408|13.601226|7.892118|6.847604|7.828905|13.812041|36.858105|
|4.029448|4.605469|12.342938|7.556481|5.022260|4.439200|4.985292|7.547370|12.621420|36.858105|
|2.400393|2.909698|5.972659|4.417123|4.974683|7.471263|12.515667|7.574024|5.005258|3.784080|36.858105|
|2.232657|2.642395|5.435910|3.874806|4.120571|5.508364|8.207436|6.638811|4.539145|3.651041|15.689639|73.516695|
|2.188111|2.621848|5.177294|3.665041|4.249179|6.085496|7.504984|5.176892|3.901977|3.091202|13.315392|14.365489|36.858105|
|1.891809|2.212446|4.277073|2.900308|3.286626|4.315941|4.933850|3.832098|3.057857|2.549170|7.556923|11.405973|13.476816|36.858105|
|1.789128|2.074512|3.925586|2.599060|2.955616|3.707576|3.936032|3.176603|2.665108|2.260327|5.079380|7.656783|8.089429|12.363449|36.858105|
|1.616414|1.847363|3.455242|2.238617|2.512548|3.034019|3.164072|2.651498|2.282318|1.979326|3.904670|6.231633|5.409548|7.719943|15.845981|73.516695|
|1.949037|2.282926|4.313491|2.875102|3.313087|4.161604|4.291524|3.427838|2.905740|2.430134|5.125909|7.260620|8.186073|8.162851|14.073813|14.937050|53.358707|
|2.257611|2.713817|5.258882|3.664405|4.317859|5.848573|6.226794|4.599769|3.735913|2.980165|7.282701|9.082968|12.521621|7.905813|8.072727|9.648799|17.761494|36.858105|
|2.462693|3.027112|5.747017|4.033492|5.071621|6.961925|6.319535|4.560210|3.876396|3.024167|6.332830|8.056796|8.683589|6.023379|6.221182|8.197098|12.497907|17.515999|0.500000|
|2.311993|2.738654|5.420104|3.721366|4.077737|5.023723|5.634824|4.750748|3.937292|3.228555|5.867449|7.924652|7.386525|5.386461|5.484253|7.466001|10.543513|12.444464|0.250204|36.858105|
|2.580275|3.069369|6.038012|4.063529|4.371539|4.918906|5.066631|4.573107|4.132727|3.414832|4.601151|6.491589|5.120235|3.954058|4.063335|5.924153|7.404328|7.475962|0.205888|13.716708|36.858105|
|2.507159|2.874835|5.685219|3.636359|3.646579|3.843746|4.043699|4.006192|3.798982|3.370685|3.689220|5.538831|3.898403|3.203102|3.272693|4.985687|5.551828|4.973867|0.133861|7.864392|13.762983|36.858105|
|2.205625|2.471024|4.925426|3.118510|3.063137|3.279474|3.620068|3.688486|3.405397|3.154595|3.494473|5.442295|3.675842|3.132868|3.174379|4.905888|5.158623|4.392888|0.111090|6.789249|7.946277|13.752909|36.858105|
|2.030382|2.287349|4.572228|2.955477|2.954636|3.307441|3.811838|3.784482|3.296416|3.010396|3.963470|6.210636|4.295714|3.715892|3.727001|5.676604|5.938308|4.976113|0.116593|7.859830|6.907961|7.953836|13.719002|36.858105|
|2.072999|2.387438|4.761367|3.179926|3.312080|3.931201|4.641377|4.259569|3.515527|3.047194|5.171031|7.651794|6.135127|5.057926|5.039723|7.182717|8.395860|7.492799|0.155964|13.731068|8.031771|6.913185|7.940231|13.744733|36.858105|
|2.100450|2.286875|4.520561|2.756199|2.644260|2.737821|2.971295|3.117114|2.996014|2.918832|2.846050|4.583344|2.923304|2.572356|2.602614|4.142248|4.082909|3.345281|0.087046|4.574697|5.279610|8.173703|13.999891|7.832058|5.184168|73.516695|
|1.859736|1.998114|3.939392|2.385448|2.284023|2.381070|2.616339|2.758830|2.624050|2.614478|2.582161|4.280181|2.640830|2.396006|2.411112|3.905662|3.655947|2.905593|0.074522|3.770188|3.985407|5.256520|7.989502|6.716259|4.513303|24.211387|36.858105|
|1.773961|1.865676|3.632832|2.142072|2.034296|2.074376|2.232814|2.368958|2.320203|2.367599|2.174725|3.644122|2.202329|2.019799|2.036552|3.349200|3.054445|2.399989|0.063028|2.970094|3.202023|4.090942|5.242073|4.420350|3.350540|14.460720|12.700240|36.858105|
|1.690908|1.756218|3.426786|1.999835|1.879182|1.904521|2.056925|2.211321|2.181897|2.279778|2.004854|3.416995|1.999015|1.846889|1.838159|3.040606|2.708691|2.126884|0.056023|2.558690|2.709015|3.309460|4.042776|3.616536|2.867891|9.769940|7.636552|14.460806|36.858105|
|1.854073|2.141983|3.961800|2.562525|2.920996|3.449855|3.410402|2.860587|2.536937|2.171777|3.758757|5.576827|5.112471|5.115684|7.796493|12.026632|18.021737|7.454249|0.189397|6.119515|5.059423|3.974246|3.639255|3.977067|5.063656|5.249183|2.629752|2.231935|1.959747|36.858105|
|1.874506|2.171025|3.909519|2.495278|2.911689|3.359874|3.134669|2.622393|2.389488|2.041345|3.315404|4.975020|4.249571|4.211373|5.754374|9.580779|10.435620|5.684336|0.170958|4.576075|4.206513|3.371012|2.996837|3.117733|3.745747|4.485596|2.245498|1.963571|1.744502|12.437402|36.858105|
|1.731561|1.964623|3.492967|2.170282|2.468366|2.726080|2.555848|2.222304|2.074255|1.815626|2.644744|4.089570|3.206195|3.197269|4.113451|7.308321|6.793557|4.044619|0.119201|3.635907|3.542489|3.030171|2.724841|2.763255|3.137369|4.214732|2.125612|1.895394|1.681940|7.544646|12.550892|36.858105|
|1.719155|1.942855|3.388719|2.077919|2.377615|2.571059|2.356120|2.058883|1.952776|1.714427|2.393775|3.742378|2.809696|2.788248|3.400116|6.062180|5.329837|3.389354|0.103060|3.029114|3.021460|2.622484|2.346614|2.346842|2.622394|3.700377|1.873759|1.699290|1.525052|5.082760|8.000483|13.526263|73.516695|
|1.751790|2.021862|3.900040|2.601105|2.886392|3.656400|4.178956|3.415032|2.763748|2.360537|6.169408|11.026040|7.883106|15.755821|7.971553|11.728255|7.494134|5.280924|0.122437|4.086197|3.193327|2.704804|2.695913|3.170936|4.045388|4.053982|2.170261|1.854552|1.719899|3.984768|3.444658|2.745257|4.359238|73.516695|
|17.570035|8.859739|12.968209|4.864248|4.023503|3.134119|2.855256|3.135021|4.000806|4.125611|2.330930|3.924997|2.097374|1.826166|1.709846|2.754495|2.503539|2.121406|0.063464|2.161891|2.364438|2.302091|2.065815|1.926199|1.966020|3.510565|1.772754|1.693709|1.630613|1.736569|1.745733|1.609677|2.836131|3.037919|0.500000|
|17.570661|8.859946|12.967065|4.871359|4.027308|3.140118|2.861590|3.138416|4.006358|4.128147|2.330421|3.848608|2.138655|1.848929|1.759317|2.827428|2.623957|2.230746|0.067018|2.337918|2.651996|2.644290|2.324401|2.104169|2.112556|3.992141|1.976672|1.902727|1.814892|1.845425|1.848343|1.719384|3.012971|3.034921|0.301067|0.500000|
|17.539610|8.855508|10.259518|4.229769|3.852041|3.006214|2.647479|2.775256|3.379364|3.286426|2.190353|3.623472|2.030503|1.777370|1.698881|2.749927|2.514625|2.107503|0.064151|2.136742|2.377017|2.303096|2.028633|1.872216|1.915168|3.445672|1.723546|1.653548|1.575075|1.777340|1.820689|1.698596|3.033369|2.933441|0.300232|0.300215|0.500000|
|8.851465|17.530829|16.547588|7.070797|6.805802|4.605459|3.747255|3.819707|4.770992|4.087700|2.920339|4.747791|2.622603|2.231243|2.079136|3.301034|3.076978|2.666112|0.083059|2.606964|2.841750|2.610293|2.270500|2.143753|2.271557|3.712423|1.845958|1.718375|1.621718|2.109035|2.163738|1.946795|3.456141|3.651336|0.212065|0.173414|0.212586|0.500000|
|8.850032|17.530915|16.550463|7.094836|6.825796|4.625286|3.762199|3.826548|4.781495|4.090933|2.919698|4.615052|2.704872|2.273291|2.170033|3.428849|3.309222|2.893566|0.091544|2.934288|3.387110|3.144758|2.628209|2.397688|2.506595|4.296417|2.079585|1.937737|1.802534|2.313265|2.368888|2.150579|3.791370|3.646423|0.173397|0.212062|0.212515|0.301416|0.500000|
|4.698300|7.474883|12.520233|8.892452|17.747646|8.930916|5.642467|4.979996|5.613756|4.086568|4.070217|6.137534|3.690901|2.975969|2.759593|4.244389|4.210562|3.855318|0.128861|3.587189|3.901833|3.296050|2.759543|2.638553|2.928002|4.302647|2.097447|1.894065|1.750543|2.812628|2.906979|2.497159|4.376318|4.684635|0.115394|0.115257|0.118582|0.228785|0.227749|0.500000|
|2.985311|3.913881|7.447132|5.658180|8.929405|17.724901|8.953479|5.675004|4.939715|3.550283|6.896857|9.061052|6.480953|4.718469|4.137412|5.976913|6.327331|6.361475|0.229459|4.879065|4.629193|3.553846|3.045150|3.109202|3.763985|4.526069|2.230869|1.949807|1.785391|3.819002|3.859560|3.030578|5.123152|6.979420|0.077655|0.077728|0.076876|0.113965|0.114208|0.217065|0.500000|
|2.804350|3.330521|7.596479|5.663975|4.978444|5.699570|8.968413|17.727295|8.965511|6.992830|7.143138|12.715116|4.910816|3.789836|3.096017|4.635154|4.434946|4.217734|0.110566|4.480756|4.155483|3.797314|3.708253|3.943023|4.352701|5.632614|2.883566|2.453691|2.315396|2.714083|2.442212|2.088930|3.417660|6.161054|0.077380|0.077370|0.068210|0.088645|0.088643|0.108009|0.124924|0.500000|
|4.298305|4.714008|12.339738|6.701073|4.591530|3.975311|4.280373|5.880303|8.833805|17.544553|3.337211|5.614170|2.847994|2.369117|2.152157|3.370271|3.191247|2.846995|0.080717|3.170539|3.488862|3.584927|3.320515|3.048019|2.994241|5.598764|2.776909|2.552077|2.454356|2.136129|2.010475|1.810384|3.038536|3.874352|0.119034|0.129644|0.096254|0.110666|0.119047|0.107755|0.090474|0.151986|0.500000|
|4.319963|4.741313|12.451676|6.730347|4.605421|3.973792|4.266741|5.868823|8.831394|17.545464|3.340835|5.858505|2.754914|2.322900|2.064883|3.250612|2.984561|2.633068|0.074850|2.772344|2.906735|2.851238|2.676729|2.572994|2.617784|4.464020|2.283982|2.105239|2.048370|1.974422|1.882848|1.685783|2.861261|3.881140|0.130212|0.119681|0.096636|0.119542|0.111266|0.108290|0.090554|0.152041|0.303113|0.500000|
|3.284134|3.657065|8.882838|5.577617|4.180894|3.983221|4.747388|7.276497|8.887256|17.576989|3.835453|6.821574|3.104174|2.588509|2.270265|3.540442|3.280035|2.929191|0.080306|3.207273|3.289057|3.290859|3.212965|3.143441|3.145896|5.313382|2.742271|2.462273|2.398458|2.137307|1.979132|1.760568|2.933368|4.306966|0.093697|0.093678|0.076984|0.092911|0.092907|0.095987|0.090614|0.223611|0.301048|0.300962|0.500000|
|2.829366|3.452077|6.604743|4.446290|5.046876|5.493894|5.087809|4.453956|4.205854|3.389507|4.372705|6.142941|4.795450|3.716091|3.835831|5.652535|6.960805|6.948497|0.228899|8.926327|17.697994|8.967500|5.660649|4.968795|5.683219|7.603306|3.332853|2.809961|2.421693|4.911554|4.459309|3.737056|5.817037|5.376405|0.070739|0.080108|0.072827|0.088627|0.109545|0.128825|0.146463|0.107655|0.096402|0.081415|0.087881|0.500000|
|2.656712|2.999803|5.835106|3.583889|3.526788|3.529225|3.574772|3.619117|3.628166|3.307186|3.179634|4.866534|3.286939|2.755134|2.816938|4.383158|4.671568|4.057204|0.114317|5.605141|8.868736|17.723427|8.969681|5.663769|4.973413|13.443583|4.863745|4.104310|3.325448|3.440747|3.066998|2.844026|4.481443|4.217862|0.066857|0.079313|0.067955|0.074284|0.092641|0.090627|0.090573|0.094188|0.100937|0.078526|0.087855|0.215011|0.500000|
|1.857109|2.060770|4.105611|2.612225|2.584262|2.866056|3.310544|3.346626|2.934844|2.762117|3.520571|5.764085|3.750342|3.405878|3.389569|5.318943|5.120613|4.081658|0.096597|5.631397|4.973081|5.640111|8.854875|17.749188|8.964739|12.436824|7.440809|4.705717|3.914307|3.458620|2.753814|2.484345|3.784502|5.353162|0.049403|0.053457|0.047715|0.053941|0.059348|0.064587|0.075243|0.099664|0.077367|0.066425|0.081656|0.107841|0.124164|0.500000|
|1.915959|2.193826|4.354836|2.898395|3.034459|3.655910|4.391581|3.973524|3.220503|2.815200|5.379550|8.290743|6.644537|5.999620|5.779404|8.174570|8.657102|6.987630|0.140980|8.952908|5.689389|4.973798|5.656108|8.955613|17.727081|7.440267|3.914319|2.993356|2.632124|4.921364|3.612304|3.004532|4.478849|8.567998|0.050978|0.053793|0.049375|0.058787|0.063228|0.074903|0.099067|0.116074|0.075460|0.068261|0.081847|0.124676|0.107889|0.217836|0.500000|
|1.869651|2.011010|4.022917|2.453095|2.320608|2.433579|2.737272|2.947680|2.769048|2.799810|2.720950|4.582796|2.724469|2.466422|2.421095|3.901751|3.607622|2.905047|0.073745|3.729701|3.802253|4.773750|7.044733|6.751481|4.591539|16.484878|17.549005|8.907907|7.229171|2.525335|2.156006|2.012133|3.170577|4.007811|0.049955|0.055011|0.047813|0.051744|0.057424|0.058529|0.062720|0.087920|0.081779|0.067476|0.083633|0.088407|0.120040|0.225290|0.113535|0.500000|
|1.725270|1.860356|3.628325|2.209402|2.156147|2.279477|2.496146|2.567072|2.405154|2.355459|2.526259|4.189169|2.648035|2.454221|2.518804|4.124091|3.804146|2.930682|0.074197|3.765291|3.833286|4.811771|7.137695|6.864297|4.645315|16.572457|17.510234|8.945428|6.094531|2.773244|2.328791|2.219890|3.437246|3.953956|0.045710|0.050473|0.044749|0.048224|0.053916|0.055352|0.060238|0.074390|0.068373|0.057772|0.068416|0.088917|0.120522|0.228962|0.114551|0.301037|0.500000|
|1.757241|1.841289|3.535706|2.068329|1.981190|2.006579|2.121961|2.222458|2.196640|2.220400|2.055737|3.418921|2.102565|1.933133|1.976467|3.267917|2.988164|2.325835|0.061814|2.855056|3.143761|4.031141|4.879564|4.000137|3.128228|13.059313|8.708567|17.679381|9.154023|2.227213|1.978877|1.938996|3.096016|3.145168|0.046291|0.052486|0.045827|0.047055|0.053602|0.051794|0.052785|0.062930|0.066753|0.055254|0.063100|0.077850|0.116565|0.113787|0.077273|0.172448|0.204052|0.500000|
|1.680221|1.747828|3.443359|2.019616|1.885710|1.920667|2.102760|2.286240|2.239064|2.366141|2.062332|3.556850|2.033262|1.881141|1.847180|3.049539|2.693130|2.125096|0.055584|2.541462|2.636691|3.153702|3.875753|3.620196|2.888761|8.835157|6.915195|9.087888|17.691135|1.919525|1.703566|1.626704|2.624973|3.136246|0.045356|0.049880|0.043279|0.044984|0.049384|0.048454|0.049782|0.067603|0.070126|0.058980|0.070413|0.065274|0.086177|0.111582|0.074718|0.216099|0.155807|0.173437|0.500000|
|1.615510|1.659186|3.205165|1.847548|1.737343|1.746023|1.864052|1.996854|1.992092|2.091151|1.810415|3.093807|1.804703|1.676896|1.674646|2.789701|2.458562|1.917366|0.050985|2.264274|2.407848|2.890627|3.378304|3.030672|2.485921|7.818334|5.479286|9.103819|17.710873|1.792668|1.616540|1.572869|2.556162|2.789870|0.043322|0.048283|0.042035|0.042594|0.047278|0.045339|0.045658|0.057635|0.062702|0.052855|0.060595|0.060887|0.082222|0.089471|0.063867|0.142725|0.130955|0.218129|0.289159|0.500000|
|1.919702|2.210309|4.102523|2.637859|2.958504|3.412562|3.387845|2.914070|2.617230|2.255829|3.594045|5.328724|4.659069|4.374698|5.843726|9.014029|12.582713|7.033280|0.181380|7.023791|6.175746|4.843437|4.334744|4.600483|5.695255|6.113728|2.983344|2.503611|2.157409|17.549166|8.821631|6.885347|8.374295|6.184640|0.049632|0.053639|0.050969|0.059567|0.066892|0.078812|0.101550|0.076773|0.062485|0.056461|0.061556|0.161089|0.114497|0.107643|0.142572|0.077977|0.087726|0.069983|0.058103|0.054557|0.500000|
|1.680095|1.913112|3.538023|2.259509|2.525422|2.937884|2.961201|2.543981|2.262725|1.974898|3.322199|5.112981|4.395031|4.745336|7.477302|13.672548|12.706869|5.634835|0.139526|4.937583|4.118778|3.453020|3.313338|3.695922|4.543969|4.905529|2.528475|2.157642|1.903800|17.599230|8.856540|6.924028|8.356506|6.897445|0.044017|0.046535|0.044862|0.052423|0.056836|0.067614|0.089011|0.068338|0.053951|0.050180|0.054512|0.108706|0.083988|0.092755|0.128898|0.067488|0.075436|0.059781|0.051869|0.048494|0.302232|0.500000|
|1.786433|2.064316|3.710997|2.368076|2.771956|3.227939|3.018420|2.508637|2.272892|1.944703|3.270919|4.987741|4.196140|4.402823|6.116246|10.859492|9.525264|5.125960|0.151001|3.969169|3.564941|2.911437|2.645863|2.794797|3.358536|4.011418|2.042614|1.797040|1.615620|8.861125|17.569648|8.920690|12.863264|6.543426|0.046581|0.048551|0.048319|0.057895|0.061812|0.077091|0.104854|0.065207|0.052694|0.050260|0.052548|0.103963|0.073913|0.069885|0.093037|0.055110|0.058783|0.050004|0.044124|0.041707|0.173588|0.212643|0.500000|
|2.081108|2.450251|4.370624|2.807745|3.369097|3.877071|3.458330|2.850209|2.624698|2.205142|3.511306|5.165102|4.395648|4.079374|5.091073|8.017336|9.390668|6.057306|0.207081|4.805290|4.640257|3.596557|3.075221|3.116888|3.731320|4.582986|2.255018|1.978471|1.758600|8.801051|17.540826|8.944867|13.110810|5.900141|0.053339|0.056734|0.056188|0.067917|0.075374|0.094941|0.126766|0.072136|0.060401|0.056440|0.058600|0.146064|0.091975|0.075348|0.097293|0.060224|0.063902|0.055429|0.047671|0.045299|0.210955|0.173366|0.302507|0.500000|
|1.778325|2.008800|3.574297|2.206266|2.478991|2.694487|2.535951|2.239032|2.109682|1.858018|2.576466|3.977042|3.074304|2.982989|3.723477|6.440835|6.322011|3.956713|0.116452|3.788624|3.852630|3.357854|2.978544|2.945853|3.266235|4.620655|2.299061|2.053176|1.801532|6.937958|8.852392|17.476468|16.465988|4.546533|0.045664|0.049497|0.048402|0.054624|0.061568|0.069493|0.081436|0.058468|0.052001|0.047674|0.049963|0.112899|0.088485|0.072911|0.084641|0.059582|0.066778|0.058971|0.047969|0.046794|0.208292|0.172932|0.173993|0.211870|0.500000|
|1.584890|1.780673|3.185618|1.972350|2.211102|2.446011|2.343087|2.057871|1.911121|1.691429|2.471531|3.886350|2.994318|3.092075|4.050203|7.617038|6.315438|3.642615|0.102796|3.313645|3.150155|2.762828|2.564377|2.647522|2.982717|4.008731|2.060491|1.840746|1.639406|6.862908|8.868677|17.493449|16.452660|4.809021|0.041231|0.043789|0.043147|0.049060|0.053543|0.061599|0.074727|0.054458|0.046754|0.043725|0.045956|0.089441|0.071684|0.067367|0.081124|0.054260|0.060503|0.052222|0.044118|0.042638|0.169204|0.206857|0.214582|0.174394|0.301301|0.500000|
|1.622680|1.811536|3.151136|1.910401|2.153812|2.297112|2.124029|1.885467|1.801650|1.600937|2.151131|3.402795|2.486138|2.476137|2.973871|5.367471|4.575411|2.948574|0.088152|2.713331|2.734251|2.436239|2.202443|2.188627|2.399125|3.526840|1.797734|1.646780|1.480439|4.283228|5.933291|9.832480|35.792561|3.927375|0.041880|0.044615|0.044915|0.050191|0.055109|0.061938|0.070375|0.049205|0.044540|0.041872|0.042881|0.081382|0.065755|0.055654|0.064062|0.047328|0.051662|0.047154|0.039676|0.038967|0.114036|0.114369|0.151788|0.152499|0.228142|0.231385|0.500000|
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