Version2.0
2020-08-02T22:09:01Z
10.1021/jm300687e
Gaussian16
RevisionB.01
CFLINN
20-Jun-2020
#N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2)
DUDE CCc1ccc2c(c1)c(c(o2)C(=O)Oc3ccc4c(c3)OC(=C([C@@H]4c5ccc(c(c5)Cl)Cl)C#N)N)C C38688332
RHF
6-31G(d)
(6D,7F)
CCc1ccc2c(c1)c(c(o2)C(=O)Oc3ccc4c(c3)OC(=C([C@@H]4c5ccc(c(c5)Cl)Cl)C#N)N)C
C01[X(C28H20Cl2N2O4)]
162
C1
588
N#CC1=C(N)Oc2c([C@H]1c1ccc(c(c1)Cl)Cl)ccc(c2)OC(=O)c1oc2c(c1C)cc(cc2)CC
N#CC1=C(N)Oc2c([C@H]1c1ccc(c(c1)Cl)Cl)ccc(c2)OC(=O)c1oc2c(c1C)cc(cc2)CC
CCc1ccc2oc(c(C)c2c1)C(=O)Oc3ccc4[C@@H](c5ccc(Cl)c(Cl)c5)C(=C(N)Oc4c3)C#N
InChIKey=DPEIBJNPDMUSHG-RUZDIDTESA-N
InChI=1S/C28H20Cl2N2O4/c1-3-15-4-9-23-19(10-15)14(2)26(35-23)28(33)34-17-6-7-18-24(12-17)36-27(32)20(13-31)25(18)16-5-8-21(29)22(30)11-16/h4-12,25H,3,32H2,1-2H3/t25-/m1/s1
InChI=1/C28H20Cl2N2O4/c1-3-15-4-9-23-19(10-15)14(2)26(35-23)28(33)34-17-6-7-18-24(12-17)36-27(32)20(13-31)25(18)16-5-8-21(29)22(30)11-16/h4-12,25H,3,32H2,1-2H3/t25-/m1/s1
CCc1ccc2c(c1)c(c(o2)C(=O)Oc3ccc4c(c3)OC(=C([C@@H]4c5ccc(c(c5)Cl)Cl)C#N)N)C
C01[X(C28H20Cl2N2O4)]
162
C01
588
N#CC1=C(N)Oc2c([C@H]1c1ccc(c(c1)Cl)Cl)ccc(c2)OC(=O)c1oc2c(c1C)cc(cc2)CC
N#CC1=C(N)O[C]2[C]([CH][CH][C]([CH]2)OC(=O)C2=[C]([C]3[C]([CH][CH][C]([CH]3)CC)O2)C)[C@H]1[C]1[CH][CH][C]([C]([CH]1)Cl)Cl
CC[C]1[CH][CH][C]2OC(=C(C)[C]2[CH]1)C(=O)O[C]3[CH][CH][C]4[C]([CH]3)OC(=C(C#N)[C@@H]4[C]5[CH][CH][C](Cl)[C](Cl)[CH]5)N
InChIKey=DPEIBJNPDMUSHG-RUZDIDTESA-N
InChI=1S/C28H20Cl2N2O4/c1-3-15-4-9-23-19(10-15)14(2)26(35-23)28(33)34-17-6-7-18-24(12-17)36-27(32)20(13-31)25(18)16-5-8-21(29)22(30)11-16/h4-12,25H,3,32H2,1-2H3/t25-/m1/s1
InChI=1/C28H20Cl2N2O4/c1-3-15-4-9-23-19(10-15)14(2)26(35-23)28(33)34-17-6-7-18-24(12-17)36-27(32)20(13-31)25(18)16-5-8-21(29)22(30)11-16/h4-12,25H,3,32H2,1-2H3/t25-/m1/s1
3748.0769248474
-2399.2821408
1-A
33707.8315
134
454
588
|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|
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10.67113
8.0044 1.4730 -0.2021
8.1414
|XX|YY|ZZ|XY|XZ|YZ|
-231.3236 -225.8814 -207.5249 -2.5707 9.1850 10.4836
|XX|YY|ZZ|XY|XZ|YZ|
-9.7470 -4.3048 14.0517 -2.5707 9.1850 10.4836
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ|
745.5324 44.9296 16.0707 75.3590 -90.6209 -64.3334 -23.9260 12.0196 66.5038 -60.6365
|XXXX|YYYY|ZZZZ|XXXY|XXXZ|YYYX|YYYZ|ZZZX|ZZZY|XXYY|XXZZ|YYZZ|XXYZ|YYXZ|ZZXY|
-38822.8590 -4979.4969 -2082.7154 688.9126 394.4096 98.0100 241.8686 27.1675 74.8539 -8065.7896 -6471.9123 -1046.9385 -110.5217 -134.3966 -115.9218
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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|
6.4337 11.8939 14.7883 21.7886 29.6658 35.4660 43.8116 51.9514 62.3047 74.8853 101.9195 114.4054 115.2189 126.0516 140.0281 147.9029 168.7880 172.6056 195.2500 204.4325 215.7764 220.9450 241.6026 257.1343 271.5663 283.6954 289.9369 301.7720 348.4058 362.9216 373.5983 384.9303 386.0202 397.4214 409.0677 414.5772 458.1503 463.4886 479.7227 487.3254 495.4083 498.8043 510.5473 515.6697 525.9904 551.5880 570.2011 588.9281 601.3887 616.3719 647.5422 666.3849 675.6990 691.5381 697.5408 717.6466 722.0299 737.0673 750.7525 763.4215 783.4763 794.4799 815.4710 826.8482 842.9848 847.3074 854.0775 858.6059 885.1681 891.0787 904.5476 933.0815 933.6482 958.3049 964.0140 985.7967 996.0533 1013.9403 1018.6667 1026.6207 1051.4615 1055.6119 1090.6463 1090.8384 1091.8020 1133.0628 1155.0297 1164.0553 1166.3237 1171.7737 1185.4440 1189.5560 1205.8103 1215.4118 1237.6541 1248.2661 1259.9652 1267.1760 1271.1487 1288.1260 1300.7927 1309.5549 1314.9110 1329.7928 1340.3389 1350.3156 1380.7227 1392.9586 1401.4386 1407.5362 1419.9685 1431.0895 1448.3164 1451.7602 1455.4267 1494.0499 1504.0148 1561.8628 1566.2497 1567.2358 1569.6050 1595.6918 1606.6377 1629.7466 1635.1289 1639.4009 1640.5240 1646.9804 1647.3954 1656.4270 1682.0480 1760.4833 1772.1573 1779.0381 1798.5731 1807.9889 1815.4324 1823.8416 1833.2701 1849.5344 1997.4045 2566.8663 3202.3510 3207.2976 3209.2302 3209.5141 3239.4932 3256.9350 3267.4711 3274.7074 3354.6399 3360.1785 3365.3456 3372.6765 3376.2226 3397.5530 3401.1350 3405.0522 3412.6555 3414.0534 3821.9571 3940.5453
4.9282 7.7614 9.4311 6.5668 7.4596 7.7668 2.9710 7.2313 8.2674 5.6107 6.6678 1.0616 5.7422 6.3731 5.8873 5.9777 4.5728 4.1508 2.7687 5.9067 10.2316 7.2618 2.7342 1.8761 4.9173 5.2876 6.7334 6.7225 5.3852 5.8131 3.1868 2.6105 4.1292 1.7094 6.2056 5.1354 5.0603 5.6823 4.6692 3.3659 3.3807 1.8810 3.2241 4.4317 3.6429 5.5595 5.0211 4.9952 4.9650 9.0058 5.9758 4.7640 5.2978 6.4084 5.6270 4.1964 7.6947 6.3714 6.0786 5.1256 6.0671 4.5183 4.7257 5.1585 3.0203 3.9857 1.7407 6.6440 3.2259 3.4246 2.5156 1.5324 2.2391 2.0646 2.0786 4.5409 3.1028 1.4183 2.4220 1.6154 2.9887 2.4562 1.3325 1.3561 1.3690 5.4127 2.0169 1.8849 1.9133 1.4961 2.2598 2.1198 4.4726 2.5889 1.5977 3.1654 2.3690 2.4209 2.2690 5.0947 2.7638 2.5373 2.3250 2.9862 2.4440 2.4894 3.1068 1.6738 1.3481 1.3905 4.5024 3.2399 1.9163 1.8831 1.7965 1.9159 3.0214 1.2420 2.0963 2.0176 2.1192 4.1948 3.0685 1.1060 1.0836 1.0445 1.0423 1.9728 2.6043 1.3636 2.9104 6.4144 3.9019 6.8943 5.6219 2.0038 7.8071 6.5314 6.6984 3.0234 12.8297 12.6856 1.0378 1.0853 1.0434 1.0594 1.1039 1.1018 1.1029 1.1044 1.0974 1.0904 1.0921 1.0911 1.0912 1.0925 1.0958 1.0952 1.0958 1.0945 1.0476 1.1042
0.0001 0.0006 0.0012 0.0018 0.0039 0.0058 0.0034 0.0115 0.0189 0.0185 0.0408 0.0082 0.0449 0.0597 0.0680 0.0770 0.0768 0.0729 0.0622 0.1454 0.2807 0.2089 0.0940 0.0731 0.2137 0.2507 0.3335 0.3607 0.3851 0.4511 0.2621 0.2279 0.3625 0.1591 0.6118 0.5200 0.6258 0.7192 0.6331 0.4710 0.4889 0.2757 0.4951 0.6943 0.5938 0.9966 0.9618 1.0208 1.0580 2.0159 1.4763 1.2465 1.4251 1.8056 1.6131 1.2734 2.3635 2.0394 2.0186 1.7601 2.1942 1.6803 1.8516 2.0779 1.2646 1.6859 0.7481 2.8858 1.4892 1.6021 1.2127 0.7861 1.1500 1.1171 1.1381 2.5999 1.8137 0.8591 1.4807 1.0031 1.9468 1.6126 0.9339 0.9507 0.9615 4.0943 1.5854 1.5048 1.5335 1.2103 1.8711 1.7673 3.8315 2.2533 1.4420 2.9059 2.2159 2.2904 2.1601 4.9807 2.7553 2.5638 2.3684 3.1112 2.5869 2.6744 3.4896 1.9135 1.5599 1.6231 5.3487 3.9094 2.3684 2.3384 2.2421 2.5197 4.0268 1.7851 3.0299 2.9198 3.0761 6.2930 4.6668 1.7308 1.7069 1.6540 1.6527 3.1530 4.1642 2.2044 4.8515 11.7131 7.2198 12.8561 10.7149 3.8593 15.1601 12.8006 13.2641 6.0935 30.1578 49.2458 6.2702 6.5780 6.3316 6.4295 6.8256 6.8860 6.9374 6.9778 7.2761 7.2537 7.2875 7.3122 7.3284 7.4303 7.4685 7.4818 7.5193 7.5165 9.0160 10.1019
0.0603 0.0751 0.1942 0.0284 1.4042 0.2799 0.0685 1.2737 0.6326 0.7351 0.7295 0.1068 1.7081 6.3993 4.1806 1.5603 1.9258 0.6739 0.0756 0.3345 0.3644 0.0412 0.3834 0.9566 3.8534 3.3620 5.4802 2.7345 4.2279 0.9006 6.6656 47.9752 2.6284 77.2575 7.9296 10.7762 3.2553 13.8014 21.3125 5.8113 4.9029 135.4259 52.5932 3.7117 21.9909 12.4913 0.9910 5.3276 7.5492 13.5313 1.1431 1.5889 5.4091 4.1759 4.0986 12.2832 6.0892 13.6881 3.5328 9.4701 22.8483 3.6841 11.3156 59.5127 15.5979 1.8838 2.9918 19.5732 13.5547 3.3991 11.3140 36.9258 29.3433 3.0624 11.7378 25.4100 2.3427 7.9957 48.1119 13.2401 4.6422 4.9955 0.5177 1.0128 1.5610 50.1079 21.1928 102.5452 14.4651 0.1022 51.5043 38.4173 0.6934 10.1048 11.0040 75.1944 54.1924 8.5664 18.7420 109.5706 63.3218 119.9785 123.9014 315.9643 136.5723 64.8643 182.7659 3.3832 8.4173 32.0301 247.2855 66.4909 417.6307 18.9139 8.8357 356.5475 372.5871 1.0929 221.3392 113.5750 41.6092 79.1455 5.4543 35.3343 1.4162 7.0522 6.7656 3.3989 76.3479 4.5960 243.6437 6.2524 225.6115 53.7473 2.0194 55.3192 154.1805 55.9729 23.9008 577.3604 423.5387 106.4798 44.3210 17.4553 18.6356 43.2893 6.8655 21.1732 73.3625 50.1975 2.0816 15.1319 12.7502 7.8611 8.5249 2.4349 6.7063 4.0351 4.9621 0.2957 104.2462 63.8871
3.7871 2.2477 4.8710 1.1005 4.7484 1.9590 2.0550 1.8383 2.0654 0.1219 0.8192 0.2882 1.0781 2.7322 1.6635 0.6117 1.9694 1.6258 1.1127 2.4346 0.4224 1.2730 1.3833 0.2089 1.1837 1.0849 1.5707 1.0723 1.2212 1.0243 1.0368 2.1204 0.4397 7.3045 2.7158 5.1226 0.1994 8.0747 5.5197 1.2037 0.9929 3.6803 1.1244 3.7685 7.5276 5.6927 3.3003 1.7065 9.1936 2.5449 1.2500 3.4680 1.1362 2.3309 2.3029 2.6619 4.1289 13.6253 7.6902 9.7988 3.7856 1.0501 6.5186 4.1710 4.4677 1.6394 3.6545 3.8417 13.6090 1.0113 10.4702 2.2484 1.7042 2.7142 0.6449 20.2665 46.4199 0.3706 24.8158 1.6776 14.8327 11.9431 0.2778 0.4489 1.0275 8.2982 5.6434 7.1369 7.6253 2.9013 10.8579 24.1484 4.4852 12.2393 23.5415 1.8512 7.3666 4.7450 7.3660 5.1579 4.7151 35.9012 8.0884 2.8951 36.1081 2.1585 18.3478 8.2584 2.1483 58.9252 194.1888 14.2146 10.3539 2.9077 14.9167 47.0511 294.1133 2.2693 23.5507 7.7775 1.0657 4.3420 138.8042 38.4535 34.7388 13.1071 24.7907 24.5839 0.5897 1.1916 8.7790 6.0918 39.7823 390.8218 65.5834 30.7408 290.2438 253.6025 39.9988 34.8268 188.7661 221.4378 79.7299 56.1172 87.7800 209.3904 96.0458 87.0907 157.0070 16.5483 46.9490 93.9169 62.3450 59.5139 47.6974 25.7353 113.5652 148.7554 95.5752 77.3280 114.8699 57.5885
0.7473 0.7484 0.7500 0.7364 0.7499 0.7379 0.7499 0.6612 0.6757 0.7262 0.4034 0.7500 0.7347 0.7166 0.7500 0.7490 0.6653 0.7033 0.5468 0.5521 0.6983 0.7150 0.1229 0.7495 0.5703 0.2380 0.7204 0.5001 0.4607 0.4451 0.6770 0.7489 0.2773 0.6356 0.7352 0.2454 0.6342 0.1035 0.6953 0.4194 0.1861 0.3831 0.7119 0.5801 0.5601 0.6766 0.4705 0.2970 0.6906 0.6786 0.7354 0.7440 0.6946 0.5122 0.4949 0.5854 0.0815 0.1527 0.2655 0.1224 0.6607 0.4052 0.1713 0.7213 0.2837 0.7424 0.3115 0.6528 0.1147 0.5084 0.2874 0.5715 0.6851 0.1916 0.4874 0.1256 0.2107 0.6915 0.2001 0.6620 0.2640 0.7497 0.3643 0.3353 0.5304 0.1123 0.6696 0.1758 0.4814 0.7499 0.6733 0.1838 0.6854 0.5754 0.7048 0.6107 0.1546 0.2897 0.1519 0.5145 0.4237 0.1507 0.5458 0.1780 0.7406 0.7299 0.2738 0.2448 0.3279 0.5696 0.2126 0.2567 0.7201 0.5198 0.2946 0.2942 0.2979 0.6741 0.6286 0.5441 0.7365 0.1793 0.3559 0.6989 0.7006 0.7497 0.7450 0.2654 0.5901 0.2045 0.3730 0.5816 0.3449 0.3916 0.5128 0.4596 0.3046 0.3293 0.1873 0.1041 0.2678 0.3050 0.1233 0.1714 0.1441 0.0523 0.7491 0.7498 0.5572 0.7212 0.5906 0.4456 0.2896 0.4515 0.3872 0.2456 0.2287 0.2271 0.2132 0.2775 0.1566 0.7071
0.8554 0.8561 0.8571 0.8482 0.8571 0.8492 0.8571 0.7961 0.8065 0.8414 0.5749 0.8571 0.8471 0.8349 0.8571 0.8565 0.7990 0.8258 0.7070 0.7114 0.8223 0.8338 0.2190 0.8568 0.7264 0.3845 0.8375 0.6668 0.6308 0.6160 0.8074 0.8564 0.4343 0.7772 0.8474 0.3941 0.7762 0.1876 0.8202 0.5910 0.3138 0.5540 0.8317 0.7342 0.7180 0.8071 0.6399 0.4580 0.8170 0.8085 0.8475 0.8532 0.8198 0.6774 0.6621 0.7385 0.1507 0.2650 0.4196 0.2181 0.7957 0.5767 0.2925 0.8381 0.4420 0.8522 0.4751 0.7899 0.2057 0.6741 0.4465 0.7273 0.8131 0.3216 0.6554 0.2232 0.3480 0.8176 0.3335 0.7966 0.4177 0.8569 0.5341 0.5022 0.6932 0.2019 0.8021 0.2991 0.6499 0.8571 0.8048 0.3106 0.8134 0.7305 0.8269 0.7583 0.2679 0.4492 0.2637 0.6794 0.5953 0.2620 0.7062 0.3023 0.8510 0.8439 0.4299 0.3933 0.4938 0.7258 0.3507 0.4085 0.8373 0.6840 0.4551 0.4546 0.4590 0.8054 0.7719 0.7047 0.8483 0.3041 0.5250 0.8228 0.8239 0.8569 0.8539 0.4195 0.7423 0.3396 0.5433 0.7354 0.5129 0.5628 0.6779 0.6298 0.4670 0.4955 0.3154 0.1886 0.4224 0.4675 0.2195 0.2926 0.2518 0.0994 0.8566 0.8570 0.7157 0.8380 0.7426 0.6164 0.4492 0.6221 0.5583 0.3944 0.3723 0.3702 0.3515 0.4345 0.2708 0.8284
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
6 6 6 6 6 6 6 6 6 6 8 6 8 8 6 6 6 6 6 6 8 6 6 6 1 6 6 6 6 6 6 17 17 6 7 7 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 15.99491 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 34.96885 34.96885 12.00000 14.00307 14.00307 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
9822.1254 55708.9438 60116.6646
0.99993 -0.01147 0.00100 0.01147 0.99993 0.00181 -0.00102 -0.00180 1.00000
1
0.00882 0.00155 0.00144
0.18374 0.03240 0.03002
9.26 17.11 21.28 31.35 42.68 51.03 63.04 74.75 89.64 107.74 146.64 164.60 165.77 181.36 201.47 212.80 242.85 248.34 280.92 294.13 310.45 317.89 347.61 369.96 390.72 408.17 417.15 434.18 501.28 522.16 537.52 553.83 555.40 571.80 588.56 596.48 659.18 666.86 690.21 701.15 712.78 717.67 734.56 741.93 756.78 793.61 820.39 847.34 865.26 886.82 931.67 958.78 972.18 994.97 1003.61 1032.53 1038.84 1060.48 1080.17 1098.39 1127.25 1143.08 1173.28 1189.65 1212.87 1219.09 1228.83 1235.34 1273.56 1282.06 1301.44 1342.50 1343.31 1378.79 1387.00 1418.34 1433.10 1458.83 1465.63 1477.08 1512.82 1518.79 1569.20 1569.47 1570.86 1630.22 1661.83 1674.82 1678.08 1685.92 1705.59 1711.51 1734.89 1748.71 1780.71 1795.98 1812.81 1823.18 1828.90 1853.33 1871.55 1884.16 1891.86 1913.28 1928.45 1942.80 1986.55 2004.16 2016.36 2025.13 2043.02 2059.02 2083.80 2088.76 2094.03 2149.60 2163.94 2247.17 2253.48 2254.90 2258.31 2295.84 2311.59 2344.84 2352.59 2358.73 2360.35 2369.64 2370.23 2383.23 2420.09 2532.94 2549.74 2559.64 2587.75 2601.29 2612.00 2624.10 2637.67 2661.07 2873.82 3693.15 4607.47 4614.59 4617.37 4617.77 4660.91 4686.00 4701.16 4711.57 4826.58 4834.55 4841.98 4852.53 4857.63 4888.32 4893.47 4899.11 4910.05 4912.06 5498.94 5669.57
0.450569
0.480621
0.481565
0.382771
-2398.831572
-2398.801520
-2398.800576
-2398.899370
3.313567D-04
MUNgauss
RevisionA2.0
retrievium
02-Aug-2020
DUDE CCc1ccc2c(c1)c(c(o2)C(=O)Oc3ccc4c(c3)OC(=C([C@@H]4c5ccc(c(c5)Cl)Cl)C#N)N)C C38688332
RHF
6-31G(d)
(6D,10F)
C1
518.080013
|X|Y|Z|
168.001348 61.923270 40.605888
75.032927
27
|36.858105|
|12.424931|36.858105|
|7.491900|12.570893|36.858105|
|5.781189|7.525734|13.502631|36.858105|
|4.202496|4.992534|7.790044|13.849595|36.858105|
|3.771011|4.460244|6.911254|8.111613|13.734545|36.858105|
|4.109655|5.015922|7.954458|6.932417|7.837675|13.782151|36.858105|
|5.535856|7.558295|13.825015|7.921476|6.741161|7.922023|13.623202|36.858105|
|3.215107|3.707072|4.997080|4.577234|5.297347|8.442002|13.144933|7.250936|36.858105|
|2.821177|3.179797|4.202286|4.260065|5.417951|8.805801|8.604235|5.290184|14.145456|36.858105|
|3.002927|3.401362|4.662600|5.252725|7.822310|14.214225|8.501691|5.367710|8.454393|13.983055|73.516695|
|2.325230|2.554395|3.173044|3.235663|3.950129|5.375266|5.192357|3.780814|7.461689|12.955206|13.979266|36.858105|
|2.150879|2.343563|2.824101|2.795084|3.252576|4.217561|4.377123|3.384266|6.339029|8.093200|9.595152|16.052849|73.516695|
|2.157976|2.347027|2.881201|3.065221|3.831150|4.863810|4.275553|3.254497|5.251536|8.205858|13.070455|14.266337|15.197113|73.516695|
|1.869705|2.007366|2.385197|2.514927|3.020134|3.601066|3.282998|2.645616|3.916691|5.259218|8.554060|8.115189|12.567497|24.611467|36.858105|
|1.761884|1.857065|2.169865|2.257919|2.644082|3.097065|2.907088|2.402655|3.453150|4.342156|6.966655|6.240793|11.085841|14.074400|13.736917|36.858105|
|1.563315|1.639121|1.879132|1.951257|2.240356|2.545286|2.408928|2.050968|2.782680|3.328607|5.484773|4.385432|8.060271|9.287150|8.012926|13.840761|36.858105|
|1.470850|1.552515|1.769415|1.847075|2.113665|2.364051|2.222765|1.911440|2.522658|2.989957|5.038873|3.811011|6.880334|8.151288|6.851063|7.862950|13.659645|36.858105|
|1.537140|1.642836|1.887926|1.987795|2.301710|2.580352|2.390232|2.036123|2.703546|3.268115|5.587319|4.177578|7.257931|9.366539|8.033926|6.919990|8.050888|13.829699|36.858105|
|1.725641|1.864392|2.186166|2.318853|2.752273|3.167117|2.878078|2.381410|3.308209|4.216830|7.198883|5.687024|9.225588|14.409773|13.881687|7.924689|6.903394|7.863555|13.737665|36.858105|
|1.437234|1.540903|1.752191|1.848141|2.115380|2.321838|2.153711|1.867432|2.382867|2.804005|4.887988|3.388591|5.879681|7.239874|5.308322|4.622057|5.222338|7.912319|13.896792|8.180468|73.516695|
|1.308128|1.392454|1.562862|1.637279|1.844327|2.001776|1.880815|1.657909|2.065563|2.369084|4.115624|2.800985|4.970042|5.741626|4.048206|3.834775|4.572697|6.859673|8.137320|5.348476|25.408769|36.858105|
|1.258488|1.328076|1.483554|1.545060|1.729707|1.879508|1.781498|1.577191|1.964275|2.234051|3.843354|2.651141|4.789807|5.352488|3.805221|3.896786|5.023412|7.697185|6.918341|4.609372|14.384970|14.154867|36.858105|
|1.317062|1.381544|1.550735|1.611959|1.813045|1.989936|1.888981|1.659464|2.106657|2.416948|4.112548|2.934333|5.353898|5.969624|4.431044|4.991912|7.496171|12.544208|7.540218|4.991523|11.657692|7.566372|12.563936|36.858105|
|1.284949|1.345308|1.503036|1.546893|1.725077|1.901593|1.831962|1.617401|2.058411|2.327441|3.894982|2.825923|5.303797|5.548084|4.017907|4.662907|6.864699|8.997646|5.904002|4.310583|9.211067|5.903013|8.976218|17.541784|0.500000|
|1.269030|1.317947|1.471294|1.537579|1.723288|1.864619|1.759242|1.558701|1.930047|2.198881|3.811592|2.596063|4.650292|5.283730|3.743891|4.307057|6.068185|7.515744|5.300845|3.993060|8.494228|5.341992|7.527496|12.458912|0.250340|36.858105|
|1.198312|1.235851|1.368230|1.419408|1.573231|1.696419|1.618818|1.448888|1.771712|1.983347|3.416789|2.308004|4.191042|4.555645|3.109217|3.636197|4.863023|5.249757|3.936420|3.185740|6.406258|4.007358|5.373640|7.524986|0.207428|13.755519|36.858105|
|1.151613|1.179387|1.298424|1.350754|1.489706|1.588450|1.511875|1.364115|1.633791|1.815345|3.165062|2.068149|3.712837|4.064215|2.685124|3.088217|3.850947|3.978463|3.202881|2.714590|5.307009|3.249428|4.036910|4.998347|0.134516|7.910026|13.756243|36.858105|
|1.164974|1.191115|1.312385|1.377478|1.524306|1.609843|1.515205|1.367902|1.619521|1.808107|3.205413|2.036642|3.588310|4.059609|2.651182|2.978994|3.586605|3.731626|3.132899|2.696670|5.250105|3.156953|3.740947|4.408844|0.111510|6.823412|7.938744|13.791813|36.858105|
|1.229781|1.264236|1.402719|1.485087|1.660168|1.751901|1.628667|1.459275|1.737838|1.967195|3.525718|2.226725|3.863844|4.551483|3.014424|3.317309|3.999167|4.339043|3.706654|3.138189|6.236208|3.702934|4.290218|4.992896|0.116974|7.901154|6.897668|7.963923|13.702041|36.858105|
|1.286496|1.333823|1.491044|1.576745|1.776816|1.898584|1.763534|1.563562|1.905441|2.184685|3.880725|2.532770|4.408862|5.270529|3.651488|4.022857|5.166488|6.165305|5.000592|3.935024|8.268985|4.962925|6.014949|7.501450|0.156100|13.718418|7.991710|6.909428|7.937529|13.792938|36.858105|
|1.233419|1.264526|1.400003|1.499276|1.676844|1.738031|1.595591|1.437766|1.671606|1.889280|3.466591|2.085855|3.547769|4.282650|2.731317|2.878624|3.231892|3.448852|3.195005|2.849551|5.518144|3.167096|3.387329|3.653968|0.087274|4.774739|4.236983|4.755503|6.970386|10.980405|7.099934|448.794386|
|1.096306|1.112278|1.215001|1.275182|1.397862|1.459033|1.376114|1.256405|1.453011|1.601729|2.860532|1.765552|3.099506|3.467468|2.190335|2.418227|2.764920|2.803792|2.460762|2.202094|4.179755|2.477153|2.809927|3.146512|0.082171|4.209548|4.781512|7.088737|10.986239|6.962533|4.747648|47.572319|448.794386|
|1.150439|1.209094|1.336349|1.385379|1.531894|1.648274|1.574941|1.413468|1.720402|1.919276|3.308694|2.223902|4.041209|4.372680|2.968851|3.064525|3.788609|5.004502|4.561832|3.433062|9.329385|8.008984|13.338363|7.512664|0.192039|6.102171|5.116631|3.988076|3.614519|3.920259|4.976575|25.063509|22.349640|36.858105|
|1.076739|1.128534|1.238424|1.279960|1.403891|1.501085|1.441501|1.305317|1.564657|1.724874|2.978398|1.968977|3.584933|3.814789|2.524308|2.607364|3.132966|3.878744|3.586645|2.851841|7.197371|5.591916|7.419582|5.345284|0.146607|4.844800|4.491707|3.706585|3.345018|3.486016|4.116584|22.831047|21.462096|16.718199|53.358707|
|1.245285|1.329125|1.480705|1.552072|1.733456|1.857540|1.747637|1.558324|1.892632|2.138704|3.754295|2.455290|4.331838|4.934149|3.290395|3.063412|3.463263|4.624899|5.445991|4.213272|15.337000|14.068076|7.903611|5.015889|0.119278|4.041704|3.259166|2.772741|2.736365|3.155755|3.934067|22.777736|17.917817|6.735660|7.310020|53.358707|
|2.935418|3.315323|4.082245|3.568878|3.818401|5.137117|7.271493|5.758446|12.716861|7.390367|9.115081|5.859734|10.797137|7.459737|3.422767|3.161104|2.619295|2.369981|2.488115|2.938390|3.924646|1.949845|1.876388|2.013733|0.055671|1.835093|1.708028|1.570656|1.537679|1.628245|1.781890|12.422247|11.098692|1.661797|2.070451|2.437056|36.858105|
|17.554627|8.772354|6.786316|5.139449|4.003561|3.789789|4.287673|5.759582|3.415390|2.940682|5.432360|2.422157|4.014288|3.944460|1.920749|1.827408|1.614697|1.505614|1.562269|1.752863|2.577884|1.320918|1.277485|1.345875|0.036611|1.296923|1.228730|1.180037|1.189530|1.251178|1.309045|10.015745|8.978968|1.166818|1.485442|1.702339|3.178040|0.500000|
|17.545763|8.776576|5.473273|4.485923|3.437788|3.125468|3.383033|4.367071|2.761016|2.447502|4.576542|2.064611|3.435670|3.424444|1.692887|1.603395|1.437127|1.358772|1.416438|1.575668|2.369336|1.220760|1.176276|1.226365|0.033311|1.183698|1.122083|1.080943|1.092652|1.149416|1.198692|9.260735|8.289393|1.081448|1.383097|1.588911|2.588783|0.301028|0.500000|
|17.552297|8.757335|6.781900|6.178762|4.469161|3.810801|3.913486|4.911391|3.069003|2.780838|5.411467|2.303011|3.746923|3.866224|1.884410|1.775903|1.576205|1.483244|1.550034|1.739715|2.576138|1.317844|1.267672|1.327979|0.035834|1.287119|1.213662|1.170904|1.190893|1.260284|1.313378|10.219931|9.023339|1.157690|1.473772|1.706767|2.735686|0.301906|0.301349|0.500000|
|8.854079|17.536186|8.908342|7.048355|4.707295|4.020569|4.254944|5.745413|3.249805|2.885014|5.580781|2.361285|3.845491|3.926462|1.905620|1.754331|1.560877|1.492522|1.587353|1.794511|2.671587|1.360228|1.291886|1.334327|0.035986|1.274546|1.193211|1.140700|1.155732|1.229352|1.295118|9.927761|8.682629|1.179295|1.500943|1.779084|2.901224|0.173061|0.213332|0.210334|0.500000|
|8.857793|17.549668|8.918602|5.619191|4.178143|3.998580|4.747195|7.242738|3.667736|3.064668|5.606647|2.490198|4.135189|4.009577|1.943677|1.804304|1.598540|1.515620|1.600840|1.809372|2.674087|1.363854|1.302493|1.352729|0.036778|1.284401|1.207801|1.149465|1.154905|1.221393|1.291431|9.745214|8.646484|1.189116|1.513464|1.774374|3.441658|0.211050|0.213087|0.172959|0.304394|0.500000|
|5.814296|7.049022|8.882094|17.701689|9.007126|5.723141|4.981651|5.652437|3.638712|3.473549|7.475650|2.773839|4.321507|4.779133|2.261873|2.047852|1.796225|1.713478|1.839433|2.116009|3.071815|1.542220|1.456119|1.511196|0.040223|1.452038|1.344084|1.286969|1.318468|1.420336|1.497249|11.615101|9.869851|1.313796|1.658920|2.003574|2.972969|0.134705|0.129536|0.186888|0.210055|0.143001|0.500000|
|3.593750|4.070828|5.561338|8.866457|17.743917|8.855123|5.598337|4.885234|4.328043|4.722142|12.323690|3.695717|5.394893|6.743848|3.038618|2.645706|2.259603|2.151219|2.356816|2.812402|3.873978|1.894685|1.768903|1.847491|0.048385|1.769277|1.606017|1.527115|1.577090|1.731678|1.847787|14.230572|11.626600|1.563827|1.948109|2.429587|3.251242|0.094544|0.084304|0.108913|0.111194|0.096174|0.214730|0.500000|
|5.331886|6.980260|8.927533|5.624093|4.882297|5.632362|8.845377|17.705406|6.428293|4.571220|7.706968|3.457619|5.737754|5.222693|2.447459|2.257931|1.947069|1.813562|1.915554|2.210863|3.132136|1.577832|1.509125|1.587337|0.043320|1.488325|1.393157|1.311029|1.306969|1.384578|1.481608|10.884786|9.655635|1.360711|1.717032|2.022018|6.083706|0.161597|0.121950|0.124387|0.145844|0.218731|0.124051|0.106356|0.500000|
|1.844957|1.925967|2.253708|2.324639|2.708159|3.202718|3.052309|2.517342|3.667296|4.546114|7.127432|6.381979|11.582822|12.774504|8.910337|17.762398|8.913806|5.609310|4.979912|5.649677|6.520738|3.163165|3.248833|4.072458|0.109700|3.714428|3.307154|2.895818|2.790461|3.023179|3.497849|21.376284|18.670192|2.666475|3.159915|3.559039|3.385800|0.053704|0.046469|0.051626|0.050062|0.051960|0.058266|0.074365|0.065946|0.500000|
|1.492565|1.549861|1.758965|1.814637|2.055837|2.313200|2.215679|1.914245|2.538568|2.951236|4.865882|3.738585|6.999175|7.492418|5.683509|8.984930|17.719789|8.933699|5.702093|4.967978|7.476991|3.944538|4.556442|6.984268|0.196594|6.367726|5.612980|4.378607|3.900748|4.131419|5.116207|25.875652|23.918648|3.645960|4.197112|4.193276|2.434051|0.042999|0.038264|0.041796|0.040932|0.042067|0.046634|0.057417|0.050875|0.215580|0.500000|
|1.769947|1.936318|2.280543|2.440668|2.917218|3.331842|2.982960|2.467340|3.363560|4.278715|7.551710|5.401419|8.452726|13.122002|8.927225|5.636228|4.971210|5.622891|8.902277|17.760490|13.366365|4.933712|4.046356|4.082607|0.099654|3.377538|2.757576|2.402160|2.412877|2.798031|3.406056|21.097843|16.169733|3.134262|3.610199|5.706400|2.936704|0.049507|0.044878|0.049553|0.052165|0.052125|0.061901|0.083376|0.063157|0.124145|0.107837|0.500000|
|1.176076|1.213608|1.339862|1.379159|1.520359|1.647534|1.589193|1.426118|1.750961|1.942772|3.304104|2.267307|4.192833|4.385681|2.976351|3.500606|4.653270|4.909516|3.696341|3.023956|6.019989|3.783320|5.090465|6.978711|0.230233|8.911681|17.718175|8.960889|5.659709|4.965021|5.662431|27.449649|31.773665|5.047356|6.196166|4.231622|1.710237|0.033578|0.030643|0.032945|0.032485|0.033098|0.036201|0.042796|0.038319|0.089489|0.152954|0.072934|0.500000|
|1.101587|1.123886|1.230336|1.273629|1.394427|1.483797|1.422388|1.292022|1.534118|1.686449|2.929880|1.904521|3.441678|3.682574|2.390551|2.740879|3.322964|3.352758|2.759882|2.391504|4.600978|2.804572|3.412852|4.079605|0.115008|5.634830|8.906477|17.751503|8.973324|5.665806|4.973586|31.496847|54.582698|3.471720|4.550632|3.331805|1.487012|0.031407|0.028807|0.031069|0.030177|0.030494|0.033767|0.039552|0.034650|0.072853|0.105703|0.059404|0.215949|0.500000|
|1.339006|1.396216|1.569629|1.673222|1.902384|2.028926|1.862262|1.641598|2.004672|2.325829|4.184457|2.697103|4.610736|5.757389|4.017728|4.197346|5.163870|6.503405|5.840631|4.534852|9.903604|5.659669|6.179954|6.939631|0.140384|8.892408|5.663350|4.973432|5.663511|9.002524|17.746737|54.966367|31.519015|4.806175|5.325581|6.038234|1.850726|0.037693|0.034571|0.038042|0.037766|0.037440|0.044123|0.055387|0.042937|0.098908|0.131734|0.109773|0.124122|0.107917|0.500000|
|1.278812|1.374201|1.533390|1.608548|1.797724|1.925912|1.810012|1.613228|1.955665|2.208501|3.886752|2.516913|4.414690|5.035581|3.288942|2.967284|3.234743|4.173140|5.169429|4.276334|14.509892|9.495950|5.880609|4.219033|0.103067|3.443774|2.837268|2.452796|2.433401|2.786806|3.391525|20.647868|16.258339|5.057626|5.808358|26.049312|1.844127|0.035562|0.033292|0.035711|0.037646|0.037477|0.042348|0.051398|0.042661|0.070663|0.079217|0.124363|0.075794|0.060844|0.106672|0.500000|
|1.171128|1.245400|1.377341|1.436796|1.590510|1.697177|1.609054|1.447062|1.737392|1.938790|3.392041|2.205253|3.927618|4.353463|2.861308|2.730246|3.103322|4.010785|4.404095|3.506797|10.859739|9.420147|7.225305|4.597865|0.113893|3.826572|3.200065|2.741142|2.675967|3.013861|3.657665|21.620281|17.682792|7.578226|8.818585|26.042233|1.659869|0.032693|0.030611|0.032721|0.034041|0.034015|0.037979|0.045356|0.038517|0.065901|0.078855|0.096076|0.085929|0.067950|0.110032|0.313051|0.500000|
|3.118910|3.410590|4.086485|3.479930|3.602327|4.636193|6.517880|5.740605|8.947474|5.836952|7.905109|4.778451|8.783823|6.456357|3.038302|2.900498|2.434022|2.185251|2.254249|2.608254|3.565410|1.793271|1.743747|1.881158|0.052209|1.738061|1.635013|1.516241|1.484756|1.560436|1.690020|11.932689|10.808404|1.557274|1.950845|2.244553|17.543778|0.096860|0.076266|0.079884|0.081182|0.099051|0.081224|0.085214|0.179002|0.088013|0.063957|0.071640|0.045522|0.040105|0.048407|0.046874|0.042726|0.500000|
|2.527231|2.796455|3.350444|3.048760|3.318928|4.343073|5.442046|4.381695|8.882476|6.902293|8.305693|6.559140|13.979859|7.988432|3.768882|3.532450|2.906941|2.599978|2.705857|3.187087|4.210938|2.091229|2.024335|2.191496|0.061147|1.971455|1.835114|1.670593|1.620423|1.711699|1.889054|12.884902|11.594792|1.783803|2.213585|2.587412|17.671707|0.075449|0.062853|0.066350|0.069466|0.080046|0.072247|0.081258|0.125720|0.105539|0.074915|0.086781|0.051396|0.043899|0.054262|0.054199|0.048930|0.300624|0.500000|
|2.931061|3.409399|4.092152|3.483588|3.604792|4.637640|6.523355|5.751843|8.948183|5.833428|7.904354|4.773485|8.770663|6.452574|3.038572|2.780351|2.363870|2.187248|2.317517|2.707673|3.730243|1.863693|1.781854|1.883263|0.052109|1.712146|1.595389|1.468891|1.438534|1.522176|1.663486|11.655448|10.419802|1.590269|1.991271|2.358686|17.544216|0.086815|0.072695|0.074636|0.083476|0.101505|0.081322|0.085272|0.179623|0.080768|0.061064|0.076555|0.044455|0.038710|0.048069|0.049919|0.044768|0.302285|0.300652|0.500000|
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