Version2.4
2021-05-28T18:54:23Z
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 CCOC(=O)C1=C(NC2=C([C@@H]1c3cc(c(cc3Br)OC)OC)C(=O)[C@H]([C@H](C2)C)C(=O)OC)C C20609380
RHF
6-31G(d)
(6D,7F)
CCOC(=O)C1=C(NC2=C([C@@H]1c3cc(c(cc3Br)OC)OC)C(=O)[C@H]([C@H](C2)C)C(=O)OC)C
C01[X(C24H28Br1N1O7)]
177
C1
566
CCOC(=O)C1=C(C)NC2=C([C@@H]1c1cc(OC)c(cc1Br)OC)C(=O)[C@H]([C@H](C2)C)C(=O)OC
CCOC(=O)C1=C(C)NC2=C([C@@H]1c1cc(OC)c(cc1Br)OC)C(=O)[C@H]([C@H](C2)C)C(=O)OC
CCOC(=O)C1=C(C)NC2=C([C@@H]1c3cc(OC)c(OC)cc3Br)C(=O)[C@H]([C@@H](C)C2)C(=O)OC
InChIKey=MYGMDXLQIZRDEE-CKBSFLJSSA-N
InChI=1S/C24H28BrNO7/c1-7-33-24(29)19-12(3)26-15-8-11(2)18(23(28)32-6)22(27)21(15)20(19)13-9-16(30-4)17(31-5)10-14(13)25/h9-11,18,20,26H,7-8H2,1-6H3/t11-,18-,20+/m0/s1
InChI=1/C24H28BrNO7/c1-7-33-24(29)19-12(3)26-15-8-11(2)18(23(28)32-6)22(27)21(15)20(19)13-9-16(30-4)17(31-5)10-14(13)25/h9-11,18,20,26H,7-8H2,1-6H3/t11-,18-,20+/m0/s1
CCOC(=O)C1=C(NC2=C([C@@H]1c3cc(c(cc3Br)OC)OC)C(=O)[C@H]([C@H](C2)C)C(=O)OC)C
C01[X(C24H28Br1N1O7)]
177
C01
566
CCOC(=O)C1=C(C)NC2=C([C@@H]1c1cc(OC)c(cc1Br)OC)C(=O)[C@H]([C@H](C2)C)C(=O)OC
CCOC(=O)C1=C(C)NC2=C([C@@H]1[C]1[CH][C]([C]([CH][C]1Br)OC)OC)C(=O)[C@H]([C@H](C2)C)C(=O)OC
CCOC(=O)C1=C(C)NC2=C([C@@H]1[C]3[CH][C](OC)[C]([CH][C]3Br)OC)C(=O)[C@H]([C@@H](C)C2)C(=O)OC
InChIKey=MYGMDXLQIZRDEE-CKBSFLJSSA-N
InChI=1S/C24H28BrNO7/c1-7-33-24(29)19-12(3)26-15-8-11(2)18(23(28)32-6)22(27)21(15)20(19)13-9-16(30-4)17(31-5)10-14(13)25/h9-11,18,20,26H,7-8H2,1-6H3/t11-,18-,20+/m0/s1
InChI=1/C24H28BrNO7/c1-7-33-24(29)19-12(3)26-15-8-11(2)18(23(28)32-6)22(27)21(15)20(19)13-9-16(30-4)17(31-5)10-14(13)25/h9-11,18,20,26H,7-8H2,1-6H3/t11-,18-,20+/m0/s1
4346.6514532677
-4073.5219176
1-A
15695.3956
135
431
566
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10.30977
-2.1046 4.2870 2.1384
5.2326
|XX|YY|ZZ|XY|XZ|YZ|
-199.7311 -190.9833 -194.7759 -22.5058 -1.6967 15.0223
|XX|YY|ZZ|XY|XZ|YZ|
-4.5677 4.1801 0.3876 -22.5058 -1.6967 15.0223
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ|
-11.3606 -92.6057 -61.4411 -0.4565 -32.2041 -97.0907 -7.3198 29.6061 3.0222 -32.5425
|XXXX|YYYY|ZZZZ|XXXY|XXXZ|YYYX|YYYZ|ZZZX|ZZZY|XXYY|XXZZ|YYZZ|XXYZ|YYXZ|ZZXY|
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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|
18.5601 19.5981 26.4710 33.6373 38.4963 54.6917 57.8522 65.1093 74.1174 82.4589 89.8905 92.9334 104.6144 121.6557 126.3591 137.0311 148.7187 163.2979 174.6973 178.3567 180.9735 185.8244 196.5757 209.0674 217.5691 222.1570 238.5802 256.7693 261.5695 282.9326 290.5906 291.6272 306.7291 312.5640 320.4241 328.3036 353.0238 362.6540 383.4495 390.5484 421.0955 422.3442 426.8176 446.4189 452.6141 477.7032 496.8036 523.5501 549.6937 573.1597 591.7802 603.8023 607.7436 633.8856 646.3596 679.3106 697.2386 703.3323 751.9224 777.4573 795.7197 805.6699 823.4934 836.3495 871.9149 876.1858 886.8006 897.3237 914.2147 926.6116 964.0565 974.6698 986.1035 993.2621 1006.6455 1024.2208 1059.9751 1065.5590 1088.1494 1102.2674 1119.6677 1143.4152 1163.2033 1171.6506 1172.4860 1197.3731 1199.5065 1205.7229 1226.7964 1237.6480 1242.1722 1252.2802 1266.2540 1294.5308 1295.2345 1297.7837 1299.7742 1310.7222 1329.5240 1332.8777 1337.0525 1338.6682 1339.9221 1365.0198 1373.9284 1387.5998 1413.9471 1419.7899 1429.4817 1430.2369 1448.9748 1464.3520 1475.4108 1493.0114 1496.3156 1523.8130 1537.0671 1542.7977 1549.5497 1554.9549 1567.3343 1576.1472 1589.7649 1622.2818 1626.9786 1630.7736 1633.0993 1634.6056 1635.1365 1635.5053 1640.6095 1642.9451 1646.2256 1647.8861 1651.2861 1651.5020 1657.1261 1660.3329 1660.5525 1660.7507 1671.4807 1704.9136 1770.8701 1809.5534 1820.1521 1867.2883 1952.8516 1974.0759 2010.6192 3186.8863 3201.4635 3206.6721 3209.3598 3211.4194 3217.5986 3223.2301 3228.4602 3229.4747 3253.2588 3259.3534 3261.1363 3268.7573 3270.4745 3280.5910 3302.0396 3307.9531 3319.3988 3324.7128 3326.0038 3328.8932 3335.5305 3335.9705 3345.6922 3352.7198 3415.4532 3431.6827 3892.1599
4.8990 3.9470 5.4601 3.5619 5.7294 4.5123 4.6485 3.9349 3.7567 3.8632 3.1086 6.0462 4.7996 5.2549 5.0787 3.3607 3.3898 1.5975 1.2299 2.8748 3.4681 2.6256 3.5932 3.5947 2.5079 1.3399 1.8079 5.2437 5.0872 1.3818 1.2983 4.5298 3.5515 3.5537 2.0262 4.2846 5.2505 3.3411 4.9260 5.2793 4.9493 4.1091 3.9740 1.5687 1.9644 8.3472 4.7955 3.0347 4.6910 6.4634 4.8805 5.6671 4.1695 5.0454 4.7212 4.5616 5.7249 5.7014 6.4552 7.5625 4.8535 3.9333 5.5185 4.5411 3.2917 2.1192 2.0105 4.0284 5.2204 6.6523 3.2556 2.3027 2.5627 1.6866 1.4769 2.2155 3.8605 4.0719 2.6219 2.9054 1.7938 3.2661 1.5412 4.1755 2.7676 4.6691 2.7514 1.7286 3.3459 2.1326 3.9943 2.4885 4.9533 1.2686 1.2688 1.2746 1.5535 2.2782 1.9017 1.6296 1.4296 1.7193 1.7423 2.8974 2.0027 1.6184 2.2178 1.8217 1.1095 2.2879 2.5548 1.9488 2.7184 2.2285 2.2527 1.5207 2.8531 1.8958 1.3797 2.1566 1.1979 1.2998 1.4323 1.0451 1.1066 1.2140 1.0423 1.2106 1.2766 1.1760 1.0555 1.0474 1.0628 1.0524 1.0485 1.0481 1.6152 1.0518 1.0897 1.1185 1.0948 2.9648 8.7110 5.8360 3.9765 8.3464 11.2297 12.8285 11.4875 1.0652 1.0350 1.0345 1.0514 1.0811 1.0402 1.0479 1.0852 1.0973 1.0294 1.0621 1.1070 1.1074 1.0980 1.0986 1.1067 1.0913 1.0850 1.1045 1.1009 1.1016 1.1029 1.1086 1.0972 1.1091 1.0898 1.0919 1.0789
0.0010 0.0009 0.0023 0.0024 0.0050 0.0080 0.0092 0.0098 0.0122 0.0155 0.0148 0.0308 0.0309 0.0458 0.0478 0.0372 0.0442 0.0251 0.0221 0.0539 0.0669 0.0534 0.0818 0.0926 0.0699 0.0390 0.0606 0.2037 0.2051 0.0652 0.0646 0.2270 0.1969 0.2046 0.1226 0.2721 0.3855 0.2589 0.4267 0.4744 0.5171 0.4318 0.4265 0.1842 0.2371 1.1223 0.6974 0.4901 0.8351 1.2510 1.0070 1.2173 0.9074 1.1944 1.1621 1.2402 1.6398 1.6617 2.1503 2.6932 1.8106 1.5042 2.2049 1.8715 1.4744 0.9585 0.9315 1.9111 2.5707 3.3652 1.7827 1.2889 1.4682 0.9803 0.8818 1.3693 2.5555 2.7240 1.8291 2.0798 1.3250 2.5159 1.2286 3.3772 2.2416 3.9440 2.3324 1.4806 2.9670 1.9247 3.6312 2.2992 4.6793 1.2526 1.2541 1.2648 1.5463 2.3061 1.9806 1.7057 1.5058 1.8153 1.8430 3.1808 2.2273 1.8360 2.6124 2.1635 1.3358 2.7574 3.1603 2.4621 3.4865 2.9268 2.9716 2.0804 3.9714 2.6587 1.9519 3.0723 1.7338 1.9025 2.1327 1.6206 1.7259 1.9022 1.6378 1.9057 2.0110 1.8534 1.6739 1.6657 1.6970 1.6837 1.6844 1.6843 2.6132 1.7084 1.7704 1.8176 1.8021 5.0774 16.0951 11.2593 7.7620 17.1465 25.2323 29.4547 27.3613 6.3738 6.2499 6.2676 6.3806 6.5689 6.3450 6.4143 6.6641 6.7426 6.4193 6.6480 6.9366 6.9712 6.9198 6.9663 7.1098 7.0360 7.0434 7.1934 7.1753 7.1927 7.2294 7.2691 7.2362 7.3452 7.4903 7.5760 9.6296
0.0889 1.3537 0.9410 0.0067 1.1167 0.0563 1.1951 5.7613 6.1730 0.1059 1.0148 1.3367 1.7156 0.4501 1.5565 0.9367 1.2305 1.2348 0.1156 1.6077 0.4811 5.1676 8.1611 2.3848 0.9046 1.4503 0.5371 1.1504 1.2737 0.1813 0.8182 1.7281 0.4803 7.0218 0.5726 6.7582 3.3254 1.7234 4.8548 7.1653 16.5531 8.4656 6.3956 59.3835 21.5697 4.0789 2.6767 0.2977 4.0148 0.3459 15.1954 30.4929 4.3333 25.2015 4.2124 2.7226 7.4713 22.8827 16.8057 3.5675 4.5123 8.3255 3.9724 13.9613 18.5067 19.4053 42.2199 4.9596 4.4925 17.3473 1.6140 3.1581 10.9587 1.2967 52.5554 22.0589 11.8442 6.2774 38.2070 11.8058 33.0695 19.2114 4.2770 22.9735 42.0285 4.6490 31.1316 16.4004 77.2487 21.5308 104.5520 10.8012 94.2519 2.2156 3.0252 4.3147 4.3573 48.5920 136.4506 58.6796 37.3093 11.5282 288.7868 257.0250 228.6492 185.4546 11.9657 110.0112 2.1934 26.6036 353.8695 75.6245 160.1226 179.6489 69.1047 3.9303 93.9086 11.4762 23.3823 229.6895 34.3646 7.1278 3.6521 4.1414 18.3076 62.0744 5.8432 4.6908 7.9449 54.4011 5.5602 4.2407 8.5401 3.8380 3.4005 11.5828 278.2801 23.4451 50.6595 72.9109 5.9019 334.7224 1.2784 49.6688 62.8576 176.5513 348.6939 285.6962 270.6452 27.4308 50.7389 44.6504 28.0143 5.9923 29.8027 45.6515 34.6267 36.6559 43.0759 14.4897 54.3337 54.2802 46.5019 51.2686 13.4468 13.9381 2.3499 49.8063 40.4839 49.6095 3.0536 26.5177 5.4549 26.0196 7.9536 4.1417 75.6147
0.7013 0.0320 2.4000 1.3099 1.1254 0.4675 0.6842 0.9795 0.7259 0.4715 0.3791 0.1577 0.2236 0.6253 0.7379 0.6848 0.0347 0.2194 0.4290 0.4647 0.7646 0.3516 1.0639 0.7097 1.3667 0.6027 1.4320 0.7212 1.9258 1.2096 0.2237 3.3844 3.1509 0.3015 0.7855 0.6583 3.3598 0.4638 0.5198 0.8181 1.6007 1.9665 0.7561 3.9784 2.4379 1.9304 2.1974 0.5597 2.4900 2.8532 1.7339 2.3352 1.6039 1.8392 0.9318 4.4042 4.8347 6.0205 1.9748 1.1606 2.7254 0.7255 12.0197 12.1303 7.2574 1.1986 1.3120 1.7562 3.1550 0.8683 7.7521 7.7771 4.2893 6.6762 1.8167 3.2765 6.2722 6.4676 3.9900 4.0067 3.4204 7.3461 1.6674 4.8473 2.6751 3.2923 3.2630 5.6004 3.3724 4.7017 4.3937 6.4976 7.1834 5.1344 2.1576 4.7332 1.3465 11.9387 6.7019 5.7681 0.9665 6.2517 9.2103 4.6021 9.0487 5.9378 4.0631 0.1406 10.5136 7.4398 16.8069 16.6431 17.9016 7.5783 15.4786 7.4224 5.8954 3.0049 1.2230 0.7199 8.9773 1.9817 3.9834 17.2690 23.4879 9.6225 20.5098 1.1877 13.9043 12.2312 19.9270 19.9211 12.5438 8.1532 25.7726 25.9177 24.0135 18.4242 16.2929 11.6661 3.2941 15.3014 12.8425 89.6799 47.8117 101.9548 5.2669 28.6616 3.7061 101.8688 63.1830 115.2085 54.9061 50.3409 133.2999 124.4784 205.1612 108.4136 104.5459 96.4401 32.7009 38.5628 41.1066 89.9188 81.8378 63.4834 26.4654 6.2592 137.8685 161.9403 52.5726 47.6992 45.6133 69.2218 20.4910 62.2021 84.0457
0.7491 0.3873 0.7475 0.7427 0.7498 0.7452 0.5911 0.7274 0.7470 0.5705 0.7500 0.4736 0.5817 0.7410 0.7064 0.7481 0.6016 0.4818 0.6630 0.3037 0.7428 0.6323 0.0915 0.7334 0.6720 0.3004 0.6810 0.0944 0.1745 0.0946 0.6985 0.1586 0.1125 0.6670 0.7374 0.2922 0.3697 0.5647 0.6251 0.4098 0.7062 0.4593 0.7253 0.7158 0.6495 0.5182 0.4038 0.7257 0.1023 0.4375 0.4150 0.2430 0.5286 0.7500 0.1003 0.3050 0.0887 0.4356 0.7196 0.5326 0.2903 0.7112 0.1319 0.2352 0.0701 0.7097 0.5115 0.5782 0.6078 0.5278 0.7368 0.2745 0.2128 0.6267 0.6107 0.5744 0.4663 0.3610 0.7447 0.4566 0.1405 0.5907 0.7290 0.6058 0.4530 0.5903 0.6969 0.5636 0.4185 0.7177 0.7191 0.0954 0.5245 0.7498 0.7464 0.7240 0.7388 0.0499 0.7456 0.3815 0.5652 0.4695 0.7397 0.7344 0.7361 0.7495 0.2364 0.7445 0.7356 0.3322 0.1863 0.1626 0.7151 0.4122 0.2159 0.4803 0.5194 0.7380 0.7380 0.6484 0.7187 0.4319 0.6170 0.7405 0.6825 0.7476 0.6997 0.7488 0.6598 0.7180 0.7498 0.7152 0.7384 0.7398 0.7498 0.7500 0.7497 0.7203 0.3646 0.7411 0.7497 0.2058 0.2257 0.6470 0.3375 0.0990 0.3697 0.3217 0.2088 0.2302 0.0358 0.0238 0.1136 0.3385 0.1284 0.0852 0.1349 0.6767 0.0167 0.1309 0.7481 0.7491 0.7500 0.5653 0.7256 0.4283 0.1826 0.6017 0.4695 0.4604 0.7464 0.7500 0.5353 0.6821 0.1885 0.2648 0.1689
0.8565 0.5584 0.8555 0.8524 0.8570 0.8540 0.7430 0.8422 0.8552 0.7265 0.8571 0.6428 0.7355 0.8512 0.8279 0.8559 0.7512 0.6503 0.7973 0.4659 0.8524 0.7747 0.1676 0.8462 0.8038 0.4620 0.8102 0.1724 0.2971 0.1728 0.8225 0.2738 0.2022 0.8002 0.8489 0.4523 0.5398 0.7218 0.7693 0.5813 0.8278 0.6295 0.8408 0.8344 0.7875 0.6827 0.5753 0.8411 0.1857 0.6087 0.5865 0.3910 0.6916 0.8571 0.1823 0.4675 0.1630 0.6069 0.8370 0.6950 0.4500 0.8312 0.2331 0.3808 0.1311 0.8302 0.6768 0.7327 0.7560 0.6909 0.8485 0.4307 0.3510 0.7705 0.7583 0.7297 0.6360 0.5305 0.8537 0.6269 0.2464 0.7427 0.8433 0.7546 0.6235 0.7424 0.8214 0.7209 0.5901 0.8356 0.8366 0.1743 0.6881 0.8570 0.8548 0.8399 0.8498 0.0950 0.8542 0.5523 0.7222 0.6390 0.8504 0.8468 0.8480 0.8568 0.3824 0.8535 0.8477 0.4988 0.3141 0.2797 0.8339 0.5838 0.3551 0.6489 0.6837 0.8493 0.8493 0.7867 0.8363 0.6032 0.7631 0.8509 0.8113 0.8556 0.8233 0.8564 0.7950 0.8359 0.8570 0.8340 0.8495 0.8504 0.8570 0.8571 0.8570 0.8374 0.5344 0.8513 0.8569 0.3413 0.3682 0.7857 0.5047 0.1802 0.5399 0.4868 0.3455 0.3743 0.0691 0.0465 0.2041 0.5058 0.2276 0.1571 0.2377 0.8072 0.0329 0.2315 0.8559 0.8565 0.8571 0.7223 0.8410 0.5998 0.3088 0.7513 0.6390 0.6305 0.8548 0.8571 0.6974 0.8110 0.3172 0.4187 0.2890
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 8 6 6 7 6 6 6 1 6 6 6 6 6 6 35 8 6 8 6 6 8 6 1 6 1 6 6 6 8 8 6 6 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 15.99491 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 78.91834 15.99491 12.00000 15.99491 12.00000 12.00000 15.99491 12.00000 1.00783 12.00000 1.00783 12.00000 12.00000 12.00000 15.99491 15.99491 12.00000 12.00000 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
14685.1976 20382.6064 21274.4020
0.99998 0.00676 -0.00054 -0.00678 0.99597 -0.08944 -0.00007 0.08944 0.99599
1
0.00590 0.00425 0.00407
0.12290 0.08854 0.08483
26.70 28.20 38.09 48.40 55.39 78.69 83.24 93.68 106.64 118.64 129.33 133.71 150.52 175.04 181.80 197.16 213.97 234.95 251.35 256.62 260.38 267.36 282.83 300.80 313.03 319.63 343.26 369.43 376.34 407.08 418.10 419.59 441.31 449.71 461.02 472.36 507.92 521.78 551.70 561.91 605.86 607.66 614.10 642.30 651.21 687.31 714.79 753.27 790.89 824.65 851.44 868.74 874.41 912.02 929.97 977.38 1003.17 1011.94 1081.85 1118.59 1144.86 1159.18 1184.82 1203.32 1254.49 1260.64 1275.91 1291.05 1315.35 1333.19 1387.06 1402.33 1418.78 1429.08 1448.34 1473.63 1525.07 1533.10 1565.60 1585.92 1610.95 1645.12 1673.59 1685.74 1686.95 1722.75 1725.82 1734.77 1765.09 1780.70 1787.21 1801.75 1821.86 1862.54 1863.55 1867.22 1870.09 1885.84 1912.89 1917.71 1923.72 1926.05 1927.85 1963.96 1976.78 1996.45 2034.35 2042.76 2056.71 2057.79 2084.75 2106.88 2122.79 2148.11 2152.86 2192.43 2211.50 2219.74 2229.46 2237.23 2255.04 2267.72 2287.32 2334.10 2340.86 2346.32 2349.67 2351.83 2352.60 2353.13 2360.47 2363.83 2368.55 2370.94 2375.83 2376.14 2384.23 2388.85 2389.16 2389.45 2404.89 2452.99 2547.89 2603.54 2618.79 2686.61 2809.72 2840.25 2892.83 4585.22 4606.19 4613.69 4617.55 4620.52 4629.41 4637.51 4645.03 4646.49 4680.71 4689.48 4692.05 4703.01 4705.48 4720.04 4750.90 4759.41 4775.87 4783.52 4785.38 4789.53 4799.08 4799.72 4813.70 4823.82 4914.08 4937.43 5599.95
0.531365
0.563573
0.564517
0.465010
-4072.990553
-4072.958345
-4072.957401
-4073.056907
3.337448D-04
MUNgauss
RevisionA2.1
retrievium
28-May-2021
DUDE CCOC(=O)C1=C(NC2=C([C@@H]1c3cc(c(cc3Br)OC)OC)C(=O)[C@H]([C@H](C2)C)C(=O)OC)C C20609380
RHF
6-31G(d)
(6D,10F)
C1
521.104914
|X|Y|Z|
66.082226 62.216970 86.358946
70.810928
16
|36.858105|
|12.589254|36.858105|
|8.007681|13.363202|73.516695|
|5.271187|8.133802|25.625191|36.858105|
|4.648312|7.279704|15.355367|15.907717|73.516695|
|4.057830|5.205213|14.511981|12.867365|14.222523|36.858105|
|3.209577|3.996403|9.512867|7.828599|11.958817|14.189239|36.858105|
|2.709191|3.178393|7.230058|5.135074|8.037302|8.086892|13.768290|53.358707|
|2.672790|3.006528|6.868039|4.466001|6.712773|6.819594|7.885222|18.861469|36.858105|
|3.082228|3.396540|8.089656|4.933148|6.954459|7.630065|6.799618|11.022720|14.253006|36.858105|
|4.004457|4.581087|12.349852|7.343915|9.110902|12.450538|7.577538|9.135313|7.619749|12.513749|36.858105|
|4.614253|5.027069|13.771909|6.917017|8.597018|8.920811|5.820664|7.011861|5.850039|8.988967|17.675601|0.500000|
|3.919797|4.313931|10.648049|5.867166|7.888139|7.513509|5.480677|6.876768|5.514200|7.549535|12.416912|0.249460|36.858105|
|3.229569|3.623143|8.253232|4.972564|7.307073|6.261625|5.360572|7.024457|5.279173|6.095512|7.537545|0.156044|13.541371|36.858105|
|2.922651|3.169599|6.706851|3.876160|6.027363|4.390532|3.935681|5.223386|3.908848|4.336040|4.993054|0.116123|7.807596|13.892167|36.858105|
|3.053278|3.150142|6.443316|3.486130|5.418149|3.736208|3.252530|4.266194|3.267293|3.747290|4.375022|0.109710|6.750790|7.944309|13.516778|36.858105|
|3.611351|3.570702|7.403193|3.756130|5.643883|3.959170|3.280365|4.234795|3.321564|4.021117|4.934078|0.131021|7.871793|6.955756|7.958457|13.894724|36.858105|
|4.234484|4.260759|9.684242|4.745135|6.674787|5.200700|4.001573|5.068017|4.069395|5.333635|7.388246|0.200120|13.878737|8.052873|6.882429|7.907895|13.616167|36.858105|
|5.060059|4.437548|9.490668|4.208208|6.005236|4.294814|3.345630|4.228736|3.429403|4.470883|5.769310|0.197512|6.597774|4.571430|4.083496|4.635524|6.797786|10.020699|2539.412838|
|2.632731|2.678988|5.243812|2.853605|4.596376|2.985514|2.692711|3.567516|2.701912|2.991023|3.345487|0.085908|4.575054|5.301796|8.148790|14.172211|7.910395|5.189678|124.566442|73.516695|
|2.555527|2.508265|4.770867|2.529168|4.098941|2.586976|2.324069|3.071189|2.342803|2.608208|2.900728|0.077273|3.774345|3.998704|5.243546|8.045883|6.760787|4.518447|121.133081|24.219564|36.858105|
|2.481421|2.699907|5.505159|3.261101|5.318128|3.627089|3.471237|4.711931|3.424463|3.562153|3.858101|0.091556|5.151930|7.900175|14.149882|8.161302|5.308454|4.632476|107.925230|13.087064|4.781084|73.516695|
|2.291626|2.547881|5.208674|3.222334|5.383595|3.670233|3.752346|5.236547|3.646931|3.559661|3.701659|0.086361|4.501975|6.744085|8.038225|5.247558|4.000740|3.812997|94.156067|8.504981|3.542981|24.258860|36.858105|
|2.812648|2.933177|6.607354|3.747920|5.486347|4.946525|4.468110|7.009293|7.846949|12.926376|7.389257|0.194930|5.887654|4.787366|3.785963|3.491987|3.854110|4.944685|155.443529|5.073885|2.562757|5.609515|3.063896|36.858105|
|2.991305|2.998697|6.656624|3.565216|5.201793|4.394013|3.786399|5.525341|5.410778|8.123135|6.634311|0.197559|5.924867|4.546767|3.756260|3.679126|4.299064|5.628689|194.564390|5.324043|2.753553|5.456784|2.869875|15.942951|73.516695|
|2.318022|2.413044|5.198962|3.008887|4.615388|3.810596|3.746681|6.202175|6.760158|7.474533|4.825285|0.127819|4.091376|3.685292|3.086688|2.842699|3.014475|3.575257|115.075588|4.319760|2.206917|4.837780|2.722945|12.452944|14.232717|36.858105|
|2.308087|2.411045|5.164529|3.003983|4.643760|3.758939|3.747078|6.129501|6.381315|6.665541|4.527219|0.123979|3.663595|3.272418|2.744446|2.539422|2.705613|3.217704|107.562536|3.892339|2.006105|4.339142|2.464037|9.076653|11.555298|17.517657|0.500000|
|2.106019|2.237198|4.774930|2.861532|4.494660|3.661482|3.853578|6.907074|7.520617|6.548930|4.322819|0.107461|3.823074|3.748513|3.163557|2.800216|2.831277|3.238886|98.192230|4.310996|2.160257|5.142791|3.013814|7.533008|9.523692|12.380261|0.247415|36.858105|
|1.898680|2.004298|4.187672|2.498811|4.002219|3.087677|3.280893|5.699229|5.548907|4.853775|3.501358|0.089588|3.139951|3.100024|2.701946|2.430923|2.449681|2.743038|85.452692|3.827921|1.944352|4.491903|2.645838|5.517658|7.670459|8.901471|0.215851|17.549853|0.500000|
|2.222086|2.434907|5.276294|3.312446|5.231495|4.442894|5.107566|10.662284|12.624429|7.552872|4.853420|0.115478|4.008519|3.996558|3.237766|2.775327|2.779468|3.230883|96.340962|4.237292|2.097798|5.290293|3.214428|6.520594|8.240835|7.748213|0.204082|12.418424|0.247961|36.858105|
|2.034762|2.151395|4.548939|2.706441|4.274971|3.398526|3.520343|6.067131|5.955203|5.548577|4.040796|0.098451|3.958031|4.139873|3.630609|3.163659|3.085592|3.389921|97.583479|4.905702|2.415646|6.018192|3.521156|6.140389|8.714207|7.348556|0.151282|12.414038|0.248005|7.508620|36.858105|
|2.119282|2.145009|4.482700|2.520225|3.923363|3.020723|2.916559|4.570683|4.429420|4.948388|3.751204|0.103739|3.426680|3.105852|2.741822|2.627196|2.810271|3.211588|108.077787|4.090206|2.142158|4.346080|2.396192|7.617841|12.475802|12.562464|0.252644|7.364996|0.189763|4.932495|5.951628|36.858105|
|1.943960|1.961262|4.041114|2.273247|3.581450|2.684369|2.612617|4.077928|3.810727|4.128871|3.270646|0.088975|3.146933|2.952497|2.692155|2.597479|2.726270|3.000725|98.658126|4.119870|2.166025|4.342948|2.386149|5.744046|9.869787|7.901442|0.167415|6.445319|0.175396|4.298246|6.221329|16.028126|73.516695|
|2.140584|2.131969|4.400321|2.429859|3.792344|2.833647|2.695707|4.079590|3.791419|4.294008|3.461676|0.100361|3.104061|2.747541|2.439594|2.383800|2.601022|2.988259|107.265240|3.735654|1.991509|3.860220|2.115649|6.223465|11.280841|8.155524|0.222794|5.188252|0.139380|4.031152|4.249430|14.440491|15.317305|73.516695|
|1.957380|1.916533|3.861849|2.106900|3.331425|2.383941|2.262696|3.352218|2.980849|3.324983|2.848291|0.082990|2.660208|2.387358|2.184972|2.181836|2.380230|2.649939|97.070924|3.490351|1.897318|3.496136|1.898806|4.438195|8.543100|5.200603|0.139966|3.900477|0.108001|3.139001|3.478762|8.162902|12.836577|23.902782|36.858105|
|2.904671|3.670589|7.910599|6.404922|12.440776|7.451948|12.608196|10.719038|5.130246|4.438081|4.815265|0.114410|3.971619|4.062475|3.265213|2.752740|2.725048|3.153995|92.861221|4.209517|2.068016|5.400815|3.367414|3.316823|5.183615|2.953973|0.083327|3.090256|0.076456|3.977730|2.868181|2.401595|3.895525|4.006408|1.938027|36.858105|
|17.547243|8.920702|10.199906|4.282677|7.181607|3.369522|2.784326|3.240719|2.332186|2.626350|3.273342|0.101570|3.242414|2.784486|2.584649|2.709907|3.122765|3.487633|137.739109|4.275382|2.368324|3.996706|2.086965|2.424664|4.555759|2.048980|0.056831|1.881338|0.047623|1.979545|1.825304|1.894783|3.117084|3.411432|1.776535|2.602673|0.500000|
|17.618719|8.852558|12.852725|4.880039|7.457177|3.973903|3.125045|3.655750|2.692474|3.157303|4.142399|0.131723|4.339804|3.517298|3.244685|3.518867|4.341444|5.041106|212.075191|5.337768|2.948821|4.800309|2.431190|2.920992|5.643230|2.375388|0.064610|2.154552|0.053663|2.239370|2.115702|2.191383|3.600940|3.905109|2.019129|2.773015|0.299995|0.500000|
|17.574777|8.853781|12.799335|4.900918|7.530658|3.975064|3.157387|3.685706|2.721962|3.174372|4.040876|0.135738|3.769958|3.050560|2.725499|2.831824|3.370661|4.045730|178.430999|4.340874|2.378451|4.120938|2.158009|2.956009|5.648030|2.435135|0.068167|2.168338|0.054434|2.274781|2.061724|2.234918|3.602768|4.083065|2.096476|2.820961|0.300482|0.301946|0.500000|
|8.817742|17.615111|16.545390|7.253011|12.935121|4.774311|3.812891|4.137101|2.827266|3.126883|4.138202|0.119182|4.145227|3.668394|3.300524|3.274276|3.602503|4.095358|135.155205|5.010173|2.622039|5.063439|2.678367|2.693445|4.862982|2.242859|0.061623|2.121994|0.052934|2.310321|2.076477|2.002165|3.296517|3.497565|1.780291|3.618342|0.212542|0.210651|0.173044|0.500000|
|8.819325|17.623515|16.532597|7.350684|13.342857|4.792642|3.881232|4.189684|2.868232|3.152318|4.051324|0.122611|3.651824|3.155520|2.764110|2.705081|2.994905|3.516192|125.458454|4.165919|2.199999|4.291065|2.328910|2.727835|4.878854|2.297867|0.064819|2.139335|0.053768|2.353876|2.029233|2.039204|3.303973|3.630596|1.835789|3.731810|0.212178|0.173114|0.211515|0.302768|0.500000|
|2.408806|2.802949|6.107566|4.259133|7.073488|5.888981|9.326451|26.107805|9.358413|5.898675|4.972988|0.113383|4.034655|4.239414|3.350796|2.767101|2.708974|3.133910|90.998601|4.225223|2.061040|5.597695|3.594820|4.272285|6.124369|4.077165|0.113966|4.762156|0.114605|7.557535|4.178054|3.086515|4.969004|4.913800|2.299107|7.636022|0.059811|0.065992|0.066847|0.075253|0.076664|0.500000|
|2.955686|3.402473|7.714067|5.021208|7.605594|6.789716|6.560604|8.968977|6.238711|6.391958|7.140147|0.143103|8.945086|17.778267|9.014143|5.652973|4.999659|5.719554|129.261612|7.612188|3.337929|12.663688|7.570784|4.682196|7.421803|3.762022|0.093788|4.032237|0.092140|4.577471|4.409983|3.071662|5.168813|4.790117|2.316588|4.835764|0.071634|0.086633|0.078212|0.095658|0.084857|0.147821|0.500000|
|3.542513|3.335006|6.593338|3.270848|5.016594|3.342782|2.812563|3.640392|2.854028|3.406258|4.049411|0.112739|5.652528|5.002112|5.644425|8.954186|17.802686|8.954314|228.915165|12.564808|7.515622|7.595823|3.333395|3.386670|6.871218|2.723557|0.068625|2.528513|0.061842|2.452422|2.728951|2.616404|4.546007|4.389027|2.311780|2.394598|0.086677|0.120824|0.092208|0.093163|0.078172|0.065733|0.108439|0.500000|
|2.262434|2.233853|4.195409|2.255349|3.717546|2.301028|2.107935|2.802759|2.121110|2.314435|2.526001|0.067165|3.169655|3.418877|4.404388|5.897531|4.922673|3.619985|100.813233|17.021290|17.646890|7.745968|3.335024|2.275119|4.287880|2.003372|0.050838|1.985399|0.050181|1.929655|2.226237|1.954862|3.542050|3.233406|1.745119|1.907642|0.059080|0.071220|0.058657|0.065165|0.055203|0.052908|0.082197|0.146646|0.500000|
|2.494016|2.410302|4.624144|2.432019|3.902834|2.521523|2.260489|3.025835|2.355694|2.654869|2.900837|0.078260|3.736464|3.816565|4.763992|7.075752|6.767270|4.592324|127.820637|16.444323|17.557773|7.520528|3.240936|2.686889|5.239977|2.315062|0.058015|2.236630|0.055949|2.128833|2.511406|2.289757|4.151185|3.784970|2.048007|1.991155|0.063887|0.079961|0.065625|0.068608|0.058993|0.056315|0.088604|0.225591|0.299834|0.500000|
|2.814047|2.715780|5.053957|2.624128|4.263184|2.609872|2.312062|2.997276|2.264678|2.535053|2.891137|0.078308|3.723752|3.801256|4.742595|7.048590|6.756560|4.580869|127.665157|16.441151|17.554770|7.491177|3.230863|2.469920|4.743435|2.111911|0.053957|2.044047|0.051195|2.007857|2.235518|2.041208|3.622235|3.421452|1.833388|2.070528|0.072906|0.091949|0.071624|0.079651|0.065425|0.055748|0.088291|0.226369|0.299918|0.298935|0.500000|
|2.059463|2.265245|4.513987|2.761083|4.709360|3.056957|3.148932|4.400722|3.072776|2.979172|3.059740|0.073456|3.607806|4.914003|5.893286|4.409740|3.421737|3.197114|82.491879|7.755418|3.336241|17.032465|17.644030|2.639423|4.436049|2.406442|0.060971|2.667749|0.066542|2.808799|3.112063|2.160215|3.866996|3.413297|1.745669|2.932921|0.052810|0.060484|0.053918|0.066419|0.058071|0.086243|0.147382|0.082090|0.090467|0.084278|0.084061|0.500000|
|2.430349|2.777391|5.692211|3.643551|6.212185|4.105219|4.286808|5.727090|3.763508|3.617938|3.886582|0.089791|4.577086|6.743582|7.055902|4.755378|3.810458|3.767350|94.076154|7.509248|3.234172|16.448616|17.550508|3.006276|4.966881|2.651319|0.067853|2.907965|0.071007|3.219660|3.249859|2.299975|4.003503|3.656109|1.835592|3.952288|0.061435|0.070806|0.063036|0.082143|0.070744|0.109218|0.227432|0.088370|0.084089|0.081819|0.084800|0.299895|0.500000|
|2.212301|2.448147|5.082830|3.161950|5.210629|3.761068|3.950464|5.874678|4.194860|3.967363|3.887459|0.089374|4.572164|6.737408|7.047894|4.748632|3.804762|3.762187|93.994066|7.500327|3.234689|16.448460|17.547506|3.409151|5.528141|3.078041|0.076215|3.540035|0.085239|3.775009|4.304262|2.667072|4.743628|4.101198|2.047896|3.447587|0.055688|0.064803|0.058754|0.070044|0.062679|0.112573|0.227280|0.088255|0.084134|0.085087|0.081599|0.299935|0.298918|0.500000|
|2.065632|2.278059|4.853792|3.085844|5.003526|4.033038|4.828262|10.112208|8.968261|5.772316|4.181161|0.098815|3.657500|3.864331|3.208391|2.699052|2.627333|2.965451|86.727512|4.184179|2.054024|5.435996|3.434469|4.945500|6.757701|5.576346|0.145461|8.807998|0.207247|17.527464|7.139400|4.041662|6.643615|5.956436|2.729079|3.981501|0.051607|0.057884|0.058015|0.061029|0.061290|0.226871|0.127093|0.064379|0.053002|0.057393|0.054315|0.084079|0.095449|0.114817|0.500000|
|2.147412|2.350385|5.024339|3.150197|5.053233|4.088946|4.739053|9.227365|8.987067|6.141861|4.275994|0.106593|3.457079|3.363542|2.779943|2.438318|2.471716|2.867178|89.106325|3.769459|1.895395|4.569604|2.758929|5.535786|7.334710|6.838135|0.213678|8.790005|0.222947|17.492888|5.502869|4.591938|6.965284|7.074756|3.095052|3.874822|0.053447|0.059318|0.061673|0.061450|0.064196|0.194739|0.104855|0.061557|0.048663|0.053406|0.050862|0.068166|0.077798|0.087418|0.303304|0.500000|
|2.227674|2.366155|5.079432|3.019846|4.696004|3.860202|3.898692|6.603097|6.489437|6.473815|4.774802|0.112141|4.939543|5.340401|4.567911|3.852031|3.704930|4.094681|110.967901|5.786935|2.775272|7.337758|4.211251|6.769455|9.732839|6.613617|0.137814|8.712080|0.173271|6.771080|17.564790|5.298759|9.538238|7.042398|3.276722|3.085701|0.055050|0.065039|0.062152|0.063723|0.061126|0.120761|0.156257|0.088416|0.070038|0.079946|0.070767|0.099761|0.105977|0.146188|0.178139|0.137258|0.500000|
|1.887126|2.012074|4.199875|2.535244|4.087146|3.139442|3.363331|5.846791|5.277278|4.595129|3.535390|0.085881|3.489213|3.804477|3.418711|2.931575|2.785273|2.990907|85.863658|4.647292|2.277583|5.930625|3.621289|4.680170|6.876377|5.422805|0.123503|8.836704|0.215853|6.899041|17.533805|4.565082|8.550570|6.213794|2.960556|2.832937|0.047433|0.054224|0.052732|0.054492|0.053070|0.117301|0.116308|0.068718|0.059142|0.064927|0.058463|0.090596|0.092384|0.126013|0.215921|0.144603|0.301810|0.500000|
|1.924395|1.999375|4.162671|2.424174|3.846463|2.947998|2.980661|4.890630|4.589529|4.564913|3.520148|0.088891|3.534917|3.623290|3.315104|3.009164|2.962857|3.182621|94.216258|4.761561|2.392344|5.518161|3.135132|5.440852|8.384202|6.659787|0.137818|8.787774|0.214027|5.478750|17.656211|6.531487|14.131127|7.998757|3.815919|2.483118|0.048217|0.055882|0.054351|0.053593|0.052333|0.094111|0.102976|0.074325|0.061524|0.070247|0.061118|0.078674|0.079613|0.103306|0.143742|0.123331|0.301932|0.301365|0.500000|
|1.963436|1.905387|3.800684|2.056830|3.264672|2.290126|2.163385|3.152870|2.749432|3.063337|2.695429|0.080025|2.489151|2.215994|2.027643|2.035184|2.236046|2.497416|94.313288|3.264589|1.787437|3.245029|1.762794|3.935573|7.618531|4.401246|0.125258|3.366664|0.093208|2.844426|2.978983|5.956104|9.198316|16.930713|17.663398|1.870778|0.049697|0.055844|0.059044|0.048854|0.051038|0.060197|0.059722|0.060821|0.045724|0.053343|0.048463|0.045126|0.047742|0.052315|0.068991|0.079448|0.079044|0.071881|0.088275|0.500000|
|2.001450|1.940005|3.900586|2.105120|3.316523|2.367566|2.218668|3.254915|2.878713|3.274162|2.869180|0.083705|2.764375|2.472991|2.294123|2.331021|2.566537|2.823418|104.167309|3.737930|2.050745|3.648826|1.952474|4.382173|8.946291|4.773611|0.121950|3.670110|0.098895|2.961446|3.454832|7.256855|12.707656|16.463828|17.641163|1.895571|0.050416|0.058081|0.059266|0.050254|0.051105|0.061576|0.065582|0.069978|0.052183|0.062333|0.054818|0.049865|0.052027|0.058241|0.072388|0.079210|0.092690|0.081219|0.107199|0.298703|0.500000|
|1.771955|1.748097|3.496898|1.929955|3.086336|2.180140|2.105855|3.149036|2.769598|2.986695|2.550014|0.072913|2.401918|2.207515|2.040192|2.023049|2.166542|2.371446|84.616082|3.275696|1.778396|3.316799|1.817804|3.836307|7.060597|4.684729|0.126213|3.777919|0.109334|3.008840|3.407685|7.182265|12.867622|16.428737|17.630896|1.827005|0.045016|0.050638|0.052275|0.045475|0.046724|0.060886|0.060122|0.058391|0.045867|0.053139|0.047502|0.046798|0.048649|0.054676|0.073945|0.082876|0.086826|0.082085|0.105946|0.298492|0.299888|0.500000|
|3.016058|3.863669|8.076451|6.460323|13.548485|6.586239|8.861346|8.215416|4.404568|3.980779|4.376151|0.110095|3.556655|3.483509|2.865611|2.498448|2.524262|2.928819|90.110356|3.853966|1.928186|4.711916|2.858509|3.083576|4.900954|2.762783|0.079548|2.810122|0.070557|3.526215|2.568454|2.277766|3.671896|3.877270|1.884988|17.637433|0.075564|0.077943|0.082163|0.103608|0.114295|0.163028|0.109490|0.062635|0.049468|0.051771|0.054125|0.070392|0.091075|0.080617|0.095746|0.098778|0.075755|0.069869|0.062819|0.051119|0.050989|0.049239|0.500000|
|2.498924|3.038248|6.362542|4.726253|8.915170|5.586345|8.891096|10.602067|5.013435|4.080790|4.097863|0.098208|3.466458|3.634382|2.996335|2.522673|2.465459|2.798324|82.856149|3.920821|1.930111|5.096781|3.262641|3.137236|4.842263|2.910503|0.082438|3.151525|0.079219|4.166305|2.910082|2.364511|3.860641|3.915113|1.895132|17.558385|0.063014|0.066838|0.068017|0.083410|0.085835|0.254666|0.121664|0.060612|0.049915|0.051825|0.053183|0.080259|0.104928|0.094821|0.120829|0.114543|0.085162|0.081702|0.069524|0.050634|0.051178|0.050143|0.300672|0.500000|
|2.935925|3.768540|7.861172|6.340250|13.502088|6.558112|8.864442|8.252226|4.309767|3.898577|4.402957|0.105030|3.915936|4.162584|3.432312|2.869736|2.788260|3.152664|90.927422|4.419231|2.154463|5.774348|3.632278|2.995531|4.796923|2.651233|0.073507|2.775071|0.068922|3.428537|2.665993|2.205714|3.629611|3.675970|1.803854|17.641836|0.073782|0.078368|0.077223|0.107828|0.105005|0.162091|0.136988|0.067916|0.055386|0.056838|0.060187|0.088070|0.123326|0.099686|0.096889|0.090940|0.080646|0.073629|0.064802|0.048337|0.049478|0.047324|0.304962|0.300522|0.500000|
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