Version2.2
2021-02-11T14:17:52Z
10.1021/jm300687e
Gaussian16
RevisionB.01
SBUNGAY
18-Nov-2020
#N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2)
DUDE COCC(=O)Nc1cccc(c1)CNC(=O)NNc2ccc(nn2)n3cccn3 C45721313
RHF
6-31G(d)
(6D,7F)
COCC(=O)Nc1cccc(c1)CNC(=O)NNc2ccc(nn2)n3cccn3
C01[X(C18H20N8O3)]
141
C1
475
COCC(=O)Nc1cccc(c1)CNC(=O)NNc1ccc(nn1)n1cccn1
COCC(=O)Nc1cccc(c1)CNC(=O)NNc1ccc(nn1)n1cccn1
COCC(=O)Nc1cccc(CNC(=O)NNc2ccc(nn2)n3cccn3)c1
InChIKey=QHBWKUNGJUZYMG-UHFFFAOYSA-N
InChI=1S/C18H20N8O3/c1-29-12-17(27)21-14-5-2-4-13(10-14)11-19-18(28)25-23-15-6-7-16(24-22-15)26-9-3-8-20-26/h2-10H,11-12H2,1H3,(H,21,27)(H,22,23)(H2,19,25,28)
InChI=1/C18H20N8O3/c1-29-12-17(27)21-14-5-2-4-13(10-14)11-19-18(28)25-23-15-6-7-16(24-22-15)26-9-3-8-20-26/h2-10H,11-12H2,1H3,(H,21,27)(H,22,23)(H2,19,25,28)/f/h19,21,23,25H
COCC(=O)Nc1cccc(c1)CNC(=O)NNc2ccc(nn2)n3cccn3
C01[X(C18H20N8O3)]
141
C01
475
COCC(=O)Nc1cccc(c1)CNC(=O)NNc1ccc(nn1)n1cccn1
COCC(=O)N[C]1[CH][CH][CH][C]([CH]1)CNC(=O)NN[C]1[CH]=[CH][C]([N][N]1)[N]1[N][CH][CH]=C1
COCC(=O)N[C]1[CH][CH][CH][C]([CH]1)CNC(=O)NN[C]2[N][N][C](C=C2)N3[N][CH]C=C3
InChIKey=QHBWKUNGJUZYMG-UHFFFAOYSA-N
InChI=1S/C18H20N8O3/c1-29-12-17(27)21-14-5-2-4-13(10-14)11-19-18(28)25-23-15-6-7-16(24-22-15)26-9-3-8-20-26/h2-10H,11-12H2,1H3,(H,21,27)(H,22,23)(H2,19,25,28)
InChI=1/C18H20N8O3/c1-29-12-17(27)21-14-5-2-4-13(10-14)11-19-18(28)25-23-15-6-7-16(24-22-15)26-9-3-8-20-26/h2-10H,11-12H2,1H3,(H,21,27)(H,22,23)(H2,19,25,28)/f/h19,21,23,25H
2466.6415435239
-1353.3847941
1-A
24600.7092
104
371
475
|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|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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10.35929
5.0204 1.1841 -2.1755
5.5981
|XX|YY|ZZ|XY|XZ|YZ|
-170.8402 -156.5740 -162.4919 -24.7488 -18.1571 -0.0958
|XX|YY|ZZ|XY|XZ|YZ|
-7.5381 6.7280 0.8101 -24.7488 -18.1571 -0.0958
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ|
346.4565 16.2151 -24.2547 -96.0875 214.4661 163.5593 33.6653 7.3842 -10.6022 -4.5086
|XXXX|YYYY|ZZZZ|XXXY|XXXZ|YYYX|YYYZ|ZZZX|ZZZY|XXYY|XXZZ|YYZZ|XXYZ|YYXZ|ZZXY|
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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 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141
|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|
9.2313 11.9595 19.6108 25.5628 31.0332 35.3507 41.6568 56.7551 67.9596 75.5302 79.6380 91.8300 121.1156 157.8927 171.8223 173.7699 205.9480 239.6463 248.0633 277.6645 282.9139 290.5931 300.7092 333.5831 339.2408 381.4137 408.3447 423.1968 448.8142 475.4134 495.1227 506.9721 524.5463 538.2335 552.2488 588.4788 606.7512 633.2047 640.8673 650.5775 675.5955 676.8420 686.6489 702.5007 719.9232 721.8173 774.3629 789.5797 808.3246 840.5688 862.4677 868.3719 872.4516 875.4167 906.4472 945.8118 959.0008 970.7260 995.9338 1008.4755 1014.8551 1024.6458 1028.5868 1031.2135 1044.7735 1070.3350 1086.7636 1120.1384 1120.3805 1122.0664 1132.0191 1132.5206 1136.0308 1139.6326 1165.1704 1200.0006 1204.4186 1224.3295 1239.7346 1260.9157 1290.5607 1294.4783 1297.9044 1299.5856 1312.2343 1338.2331 1341.4508 1361.5014 1386.7914 1394.0531 1402.4781 1416.6912 1422.4010 1438.0113 1468.6542 1478.8351 1507.4058 1525.9503 1533.6213 1574.9398 1579.2738 1595.4109 1600.1641 1631.7855 1632.1988 1639.5352 1646.0167 1649.7651 1663.4724 1669.7404 1670.3393 1678.0041 1728.8654 1741.8441 1751.3835 1796.0082 1804.1009 1818.0005 1841.3312 1948.7661 2000.4228 3156.5953 3179.9343 3187.4108 3226.0464 3250.0016 3318.6143 3324.4012 3351.6129 3362.7237 3374.3841 3386.5564 3436.5895 3448.9707 3459.2258 3463.9745 3496.6466 3807.8864 3813.1882 3868.1865 3901.0822
6.9228 6.2744 5.3445 2.7861 5.2152 5.5197 5.8610 3.0242 5.0805 6.0689 5.3854 5.5826 4.1930 5.8897 6.5711 5.8108 4.9884 1.4380 2.9149 4.1446 4.7466 4.6564 4.1743 4.8553 5.9454 4.2183 4.8387 3.8699 2.9951 4.0460 5.6046 2.9383 5.3079 1.3541 1.3087 3.7387 2.4827 2.9956 3.3641 2.5349 3.1605 3.7824 4.6748 7.1108 4.7735 5.0959 3.0009 4.0996 3.3547 4.1422 4.3647 1.1984 5.0677 2.9855 1.6106 2.4345 2.7065 2.1102 3.3715 6.4066 1.2945 5.0467 1.5878 1.4783 1.4003 4.4938 5.9763 1.3337 2.7484 2.8467 1.3181 1.7263 2.1825 2.9939 2.2999 2.0623 1.7488 2.7920 2.9294 1.6386 2.0474 2.1003 1.8323 1.7260 1.4425 2.2311 1.9262 3.0623 2.4960 1.4758 1.4323 1.7098 2.8650 2.2185 1.8787 1.5093 8.0606 2.8493 1.4454 4.4733 1.6928 2.6695 1.8771 1.1756 1.2907 1.1982 1.0481 1.0710 3.3628 2.4592 1.1188 1.6213 2.2175 2.0236 4.7907 4.4095 6.9784 4.8081 6.5521 7.0104 9.5547 1.0540 1.0402 1.1044 1.1056 1.0693 1.0985 1.0990 1.0890 1.0923 1.0955 1.0937 1.0955 1.0967 1.0992 1.0937 1.1040 1.0773 1.0769 1.0780 1.0778
0.0003 0.0005 0.0012 0.0011 0.0030 0.0041 0.0060 0.0057 0.0138 0.0204 0.0201 0.0277 0.0362 0.0865 0.1143 0.1034 0.1247 0.0487 0.1057 0.1883 0.2238 0.2317 0.2224 0.3183 0.4031 0.3616 0.4754 0.4084 0.3555 0.5388 0.8095 0.4450 0.8605 0.2311 0.2352 0.7628 0.5385 0.7077 0.8141 0.6321 0.8499 1.0209 1.2986 2.0676 1.4577 1.5643 1.0602 1.5059 1.2914 1.7244 1.9129 0.5324 2.2727 1.3480 0.7797 1.2831 1.4665 1.1716 1.9703 3.8389 0.7856 3.1218 0.9898 0.9262 0.9006 3.0332 4.1586 0.9859 2.0326 2.1117 0.9952 1.3046 1.6595 2.2910 1.8396 1.7497 1.4947 2.4658 2.6527 1.5349 2.0091 2.0736 1.8186 1.7175 1.4635 2.3541 2.0422 3.3445 2.8282 1.6898 1.6599 2.0219 3.4152 2.7030 2.3875 1.9447 10.7914 3.9090 2.0030 6.5374 2.4875 4.0034 2.8318 1.8443 2.0259 1.8977 1.6730 1.7174 5.4826 4.0397 1.8392 2.6897 3.9052 3.6173 8.6578 8.3803 13.3822 9.3630 13.0887 15.6861 22.5274 6.1878 6.1973 6.6107 6.7795 6.6543 7.1278 7.1558 7.2077 7.2776 7.3492 7.3903 7.6232 7.6861 7.7499 7.7319 7.9530 9.2034 9.2257 9.5032 9.6644
0.5964 0.4776 0.2012 11.9649 0.3336 4.4694 1.1656 2.3468 13.1316 3.1062 5.0230 3.0083 0.9533 0.7686 2.3340 0.0717 4.1150 3.0669 0.8807 1.1703 57.2877 5.2815 2.0407 3.2092 2.2968 6.0295 8.0563 8.8114 1.5671 2.7701 7.9171 15.4939 31.9486 106.5288 98.6940 23.1120 63.0323 97.2575 53.7525 21.2684 10.6621 1.1038 28.7010 11.9546 47.5801 2.3503 31.5084 2.7927 11.1266 16.4778 1.5475 62.7933 90.6770 104.9372 49.1955 45.3078 7.8745 82.9308 6.9136 8.9331 0.7343 93.1778 3.9696 26.1376 1.8810 12.1299 0.2866 2.6817 12.4574 40.8657 0.7741 52.7457 3.0585 28.9610 23.6971 7.6455 8.0422 12.6533 16.9624 16.5673 59.4805 80.3982 35.4516 4.6028 131.6987 81.5002 52.9323 26.9403 84.0264 19.7613 70.3237 238.1442 113.5309 207.3153 16.5266 50.8913 2.5414 32.5070 12.2406 171.8797 72.3813 21.2099 12.4186 7.2985 42.6875 45.2662 5.2769 10.7335 707.6040 146.3759 0.6753 221.1343 480.7351 348.2920 74.8502 15.4323 15.0718 154.7937 18.4729 391.5804 282.7574 35.9003 66.8827 56.5501 82.2559 36.1878 43.4994 3.5611 12.3513 5.8635 31.7089 6.5889 11.2734 1.3192 2.7570 2.4612 3.5717 38.3085 37.8605 29.6014 47.2524
0.4465 2.0256 1.7268 3.6871 1.4220 4.1324 1.3386 2.2005 0.2339 1.8038 1.4017 1.3224 0.7902 0.2155 0.4613 3.3100 1.0353 1.0655 2.2607 2.5357 0.8859 1.6410 4.1893 1.1004 2.7201 5.9845 0.4913 0.3249 1.7567 0.4836 0.5869 2.3981 1.0004 0.8105 1.4791 3.2347 0.8091 1.4884 1.2792 1.9587 0.1985 0.8806 1.2991 3.4124 4.3163 0.6253 0.8573 5.3108 3.9745 2.8362 1.4000 0.8052 9.3031 2.7528 1.3744 9.3798 5.1303 7.2075 0.9685 8.0878 0.9965 6.9407 0.7140 1.5251 1.2962 4.8958 57.2916 0.6061 2.5240 4.8861 0.2161 6.0236 2.9742 8.1033 4.4940 3.4787 20.7808 6.6579 10.5708 1.0841 6.5575 9.4988 12.9990 2.1369 2.4830 7.4629 11.9502 28.4953 0.7648 6.1072 33.7481 17.2297 3.7881 13.4122 1.8533 1.8055 106.5702 81.4126 12.8639 42.6729 0.0915 24.9770 4.9323 12.3286 7.5704 11.9348 22.7283 4.6261 101.4811 5.5450 13.7947 2.5345 9.6273 8.6942 7.4302 40.4616 1.5897 31.0134 204.0053 4.4879 19.7859 31.1673 152.7206 40.1012 56.8173 68.2060 115.1749 41.1149 62.7414 34.1735 169.5294 84.3801 118.3260 66.1516 146.8752 63.0465 48.3240 74.7454 81.9325 42.9188 40.5736
0.7494 0.7486 0.7484 0.7498 0.6488 0.7453 0.7368 0.7304 0.6853 0.7498 0.7193 0.7424 0.7428 0.3589 0.6985 0.7415 0.6050 0.5647 0.5230 0.5421 0.7497 0.5703 0.3645 0.5135 0.3391 0.7460 0.7074 0.6982 0.3495 0.2731 0.6330 0.3784 0.5104 0.6858 0.6718 0.5218 0.7500 0.3636 0.4456 0.4718 0.3361 0.3608 0.7381 0.7486 0.7319 0.7500 0.6324 0.1265 0.3096 0.5206 0.7500 0.7495 0.3422 0.4694 0.6739 0.3250 0.2031 0.4337 0.5613 0.7189 0.7494 0.2498 0.6186 0.7264 0.7497 0.1124 0.1247 0.7285 0.2012 0.7152 0.5396 0.1939 0.4385 0.2276 0.2102 0.3893 0.1608 0.5477 0.5304 0.6492 0.1558 0.6591 0.4852 0.6088 0.7360 0.0454 0.1827 0.1279 0.4897 0.6256 0.3182 0.1265 0.2796 0.2246 0.4227 0.7202 0.1396 0.3328 0.3883 0.7440 0.6005 0.1748 0.7475 0.6845 0.7351 0.7288 0.7500 0.7456 0.3231 0.3487 0.7422 0.6154 0.4738 0.5003 0.2727 0.5318 0.3331 0.7111 0.3907 0.0873 0.2493 0.0962 0.0344 0.7005 0.7365 0.1225 0.4786 0.4585 0.6743 0.2331 0.2086 0.3460 0.5071 0.2123 0.2325 0.2363 0.1494 0.0276 0.3553 0.1357 0.1939
0.8568 0.8562 0.8561 0.8570 0.7870 0.8540 0.8484 0.8442 0.8133 0.8570 0.8367 0.8522 0.8524 0.5282 0.8225 0.8516 0.7539 0.7218 0.6868 0.7030 0.8569 0.7264 0.5343 0.6785 0.5065 0.8545 0.8286 0.8223 0.5179 0.4290 0.7753 0.5490 0.6758 0.8136 0.8037 0.6857 0.8571 0.5333 0.6165 0.6412 0.5031 0.5303 0.8493 0.8562 0.8452 0.8571 0.7748 0.2246 0.4728 0.6847 0.8571 0.8568 0.5099 0.6389 0.8052 0.4906 0.3377 0.6050 0.7190 0.8364 0.8567 0.3997 0.7643 0.8415 0.8569 0.2021 0.2218 0.8429 0.3350 0.8339 0.7010 0.3248 0.6097 0.3707 0.3474 0.5604 0.2770 0.7078 0.6931 0.7873 0.2697 0.7946 0.6533 0.7569 0.8479 0.0869 0.3089 0.2268 0.6575 0.7697 0.4828 0.2245 0.4370 0.3668 0.5942 0.8373 0.2451 0.4994 0.5593 0.8532 0.7504 0.2975 0.8555 0.8127 0.8473 0.8431 0.8571 0.8542 0.4884 0.5171 0.8520 0.7619 0.6429 0.6669 0.4285 0.6943 0.4997 0.8312 0.5619 0.1607 0.3991 0.1755 0.0665 0.8239 0.8483 0.2182 0.6473 0.6287 0.8055 0.3780 0.3452 0.5141 0.6730 0.3503 0.3773 0.3823 0.2600 0.0538 0.5243 0.2390 0.3248
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
6 8 6 6 8 7 6 6 6 6 6 6 6 7 6 8 7 7 6 6 6 6 7 7 7 6 6 6 7 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
12.00000 15.99491 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 14.00307 14.00307 12.00000 12.00000 12.00000 12.00000 14.00307 14.00307 14.00307 12.00000 12.00000 12.00000 14.00307 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
3874.0055 42611.0631 44413.5440
0.99998 -0.00657 -0.00074 0.00658 0.99992 0.01042 0.00068 -0.01043 0.99995
1
0.02236 0.00203 0.00195
0.46586 0.04235 0.04063
13.28 17.21 28.22 36.78 44.65 50.86 59.93 81.66 97.78 108.67 114.58 132.12 174.26 227.17 247.21 250.02 296.31 344.80 356.91 399.50 407.05 418.10 432.65 479.95 488.09 548.77 587.52 608.89 645.74 684.01 712.37 729.42 754.71 774.40 794.56 846.69 872.98 911.04 922.07 936.04 972.03 973.82 987.93 1010.74 1035.81 1038.53 1114.14 1136.03 1163.00 1209.39 1240.90 1249.39 1255.26 1259.53 1304.18 1360.81 1379.79 1396.66 1432.93 1450.97 1460.15 1474.24 1479.91 1483.69 1503.20 1539.97 1563.61 1611.63 1611.98 1614.40 1628.72 1629.44 1634.49 1639.68 1676.42 1726.53 1732.89 1761.54 1783.70 1814.18 1856.83 1862.47 1867.39 1869.81 1888.01 1925.42 1930.05 1958.90 1995.28 2005.73 2017.85 2038.30 2046.52 2068.98 2113.07 2127.71 2168.82 2195.50 2206.54 2265.99 2272.22 2295.44 2302.28 2347.78 2348.37 2358.93 2368.25 2373.64 2393.37 2402.38 2403.25 2414.27 2487.45 2506.13 2519.85 2584.06 2595.70 2615.70 2649.26 2803.84 2878.16 4541.64 4575.22 4585.97 4641.56 4676.03 4774.75 4783.07 4822.22 4838.21 4854.99 4872.50 4944.49 4962.30 4977.05 4983.89 5030.89 5478.70 5486.33 5565.46 5612.79
0.418521
0.443436
0.444380
0.355994
-1352.966274
-1352.941358
-1352.940414
-1353.028801
2.964515D-04
MUNgauss
RevisionA2.1
retrievium
11-Feb-2021
DUDE COCC(=O)Nc1cccc(c1)CNC(=O)NNc2ccc(nn2)n3cccn3 C45721313
RHF
6-31G(d)
(6D,10F)
C1
396.165837
|X|Y|Z|
148.927205 26.640809 41.371964
54.753160
22
|36.858105|
|13.667798|73.516695|
|8.192479|24.570013|36.858105|
|5.209018|14.259294|12.485604|36.858105|
|4.700328|12.621020|7.973449|15.981219|73.516695|
|4.046501|9.525289|7.931648|13.967770|14.925953|53.358707|
|3.138923|6.988530|5.040838|7.607709|11.518142|18.404715|36.858105|
|2.848706|6.325640|4.202837|6.259021|11.630705|10.497164|13.674763|36.858105|
|2.361038|5.028161|3.232663|4.310054|7.955361|6.990746|7.969645|13.775804|36.858105|
|2.158682|4.481707|2.908068|3.666394|6.397860|6.193502|6.852595|7.885637|13.744226|36.858105|
|2.275191|4.695630|3.142533|3.882102|6.371927|7.060628|7.878195|6.813796|7.946330|13.744352|36.858105|
|2.706689|5.712425|4.026310|5.155713|7.880170|10.890015|13.718184|7.920919|6.931652|7.966555|13.727039|36.858105|
|2.006588|4.019233|2.644898|3.069171|5.025192|5.302232|5.011591|4.417425|5.015700|7.532589|12.558998|7.579732|36.858105|
|1.948027|3.865940|2.512612|2.846740|4.640192|4.826800|4.290044|3.761588|4.093921|5.485227|7.661558|6.016512|13.131162|53.358707|
|2.020461|3.960406|2.590896|2.839695|4.522962|4.811320|3.991972|3.355853|3.430085|4.213534|5.728979|5.439705|7.786044|19.256420|36.858105|
|2.139355|4.160924|2.772045|2.971809|4.630395|5.093703|4.060606|3.290252|3.249356|3.872814|5.330850|5.563458|6.775227|11.475963|15.832688|73.516695|
|1.918720|3.721272|2.380168|2.560607|4.123098|4.179325|3.343940|2.901145|2.943815|3.453688|4.278593|4.166921|5.175761|11.168978|13.704930|15.126807|53.358707|
|1.737702|3.368100|2.111665|2.290177|3.777947|3.645864|2.959606|2.688922|2.810659|3.300063|3.840572|3.554892|4.605937|9.644000|7.960171|9.764274|18.785653|53.358707|
|1.553101|2.974046|1.846843|1.978034|3.290211|3.091707|2.483190|2.294415|2.416593|2.817441|3.189397|2.928216|3.886535|7.335702|5.815235|8.010794|10.865302|18.529907|36.858105|
|1.425742|2.723519|1.667583|1.787076|3.015962|2.741835|2.198851|2.084298|2.215578|2.539924|2.755453|2.517043|3.228464|5.650358|4.168455|6.052528|7.062518|10.703945|13.457497|36.858105|
|1.305401|2.473782|1.506877|1.601190|2.711786|2.432004|1.933923|1.843557|1.957523|2.224343|2.388293|2.191462|2.789723|4.627880|3.421491|5.215296|5.461345|7.129395|8.059600|14.109708|36.858105|
|1.292198|2.435369|1.490635|1.571469|2.644778|2.393305|1.890998|1.783829|1.882023|2.145212|2.338886|2.160160|2.782553|4.548993|3.460672|5.432247|5.377500|6.437540|7.245590|8.108860|13.461349|36.858105|
|1.379544|2.600606|1.607212|1.690097|2.816404|2.602439|2.053417|1.905325|1.996923|2.297760|2.571146|2.387283|3.138436|5.236346|4.162551|6.570341|6.472391|7.320910|8.398493|7.005354|8.012309|14.779658|53.358707|
|1.520598|2.888459|1.801716|1.907427|3.152853|2.982578|2.369936|2.166982|2.264743|2.639320|3.031619|2.813642|3.782128|6.816346|5.720753|8.470561|9.663784|11.196462|14.745798|8.021786|6.967449|8.392175|19.568542|53.358707|
|1.186614|2.222273|1.352030|1.416453|2.394511|2.134991|1.674759|1.590765|1.674803|1.886839|2.031279|1.887926|2.375863|3.722963|2.809309|4.562268|4.206617|4.779714|4.730337|5.235914|7.809956|13.609482|11.315995|7.350482|53.358707|
|1.152780|2.147337|1.307362|1.360271|2.294494|2.045394|1.593605|1.508039|1.578824|1.771622|1.914514|1.793642|2.236206|3.423521|2.610624|4.365726|3.807332|4.121079|3.860824|3.954464|5.112220|7.712705|9.230919|6.273087|19.171634|36.858105|
|1.065688|1.978886|1.196731|1.242558|2.107914|1.851681|1.437834|1.372186|1.436482|1.595653|1.701242|1.598279|1.951561|2.932651|2.208862|3.718532|3.193852|3.449078|3.105958|3.277196|4.160612|5.375799|6.301207|4.768696|11.916858|14.036180|36.858105|
|1.049707|1.954693|1.177324|1.227830|2.092936|1.824647|1.421788|1.367003|1.437299|1.592441|1.680770|1.572118|1.912272|2.890880|2.149784|3.563176|3.145219|3.489029|3.156200|3.529194|4.690106|5.553330|5.919182|4.610401|12.360499|8.702760|13.448551|36.858105|
|1.113877|2.084139|1.258503|1.319362|2.246483|1.971157|1.544677|1.483499|1.565477|1.746038|1.848044|1.718171|2.118189|3.269297|2.424850|3.941372|3.614275|4.138102|3.899512|4.604979|6.826910|8.005488|7.361812|5.579907|19.325967|8.533065|8.478042|14.690296|53.358707|
|17.502152|16.445163|7.243306|4.699451|7.275725|5.305915|3.033809|2.698680|2.262805|2.105351|2.251414|2.684707|2.012459|2.697636|2.087917|3.951948|2.724465|2.449103|1.605578|1.467958|1.342449|1.331137|1.939979|2.143484|1.661052|1.185987|1.094157|1.076312|1.555639|0.500000|
|17.634415|16.930296|5.900662|4.356319|7.474724|4.683333|2.783290|2.602781|2.190300|1.994427|2.070886|2.412238|1.835611|2.435430|1.843575|3.431525|2.405151|2.204973|1.455523|1.347828|1.237723|1.220974|1.763132|1.933212|1.531403|1.091961|1.013774|1.001604|1.444673|0.299726|0.500000|
|17.508210|16.462630|7.258718|4.770094|7.654502|5.199901|3.003758|2.725557|2.279283|2.096826|2.213945|2.620973|1.965142|2.569103|1.955314|3.714427|2.504920|2.265018|1.498513|1.373963|1.264777|1.259306|1.833807|2.012385|1.580212|1.133434|1.048818|1.029375|1.481567|0.299351|0.299697|0.500000|
|7.227050|16.589384|17.472721|8.823579|10.604489|10.213931|4.850640|3.884850|3.070884|2.851569|3.170097|4.109642|2.722757|3.603064|2.802747|5.394466|3.535086|3.084060|1.966928|1.760213|1.583811|1.569716|2.316913|2.615596|1.929150|1.369744|1.248515|1.226166|1.787970|0.214125|0.147168|0.173694|0.500000|
|7.354295|16.550173|17.458373|8.967903|11.522957|9.296789|4.647039|3.894366|3.068587|2.798787|3.038125|3.848125|2.591837|3.295666|2.496214|4.824825|3.083573|2.730114|1.774886|1.600205|1.457073|1.453044|2.139180|2.383478|1.803140|1.289362|1.181337|1.156623|1.675389|0.177867|0.148391|0.219193|0.301360|0.500000|
|4.065774|9.045726|7.787586|9.449804|10.875719|26.059652|9.375562|5.748943|4.307875|4.099900|4.947336|7.730411|3.946675|5.002258|3.833779|7.518422|4.500198|3.809498|2.367852|2.070411|1.836560|1.822839|2.726337|3.143640|2.208136|1.560233|1.405662|1.377649|2.024899|0.113294|0.094199|0.107591|0.239841|0.194361|0.500000|
|3.042926|6.927048|4.427077|6.841949|15.043896|9.513888|8.895415|17.829146|8.914998|5.629425|4.929784|5.642858|3.540281|4.250477|2.857323|5.015249|3.460234|3.238814|2.057018|1.892732|1.687932|1.631164|2.354133|2.648403|1.996228|1.393661|1.276856|1.274459|1.874155|0.078285|0.078126|0.080317|0.108926|0.112264|0.143149|0.500000|
|2.195850|4.632646|2.883686|3.741181|7.208135|5.655382|5.666877|8.977750|17.710963|8.925473|5.651265|4.981874|4.086876|4.707435|2.930709|4.921008|3.521079|3.439537|2.213645|2.070956|1.847034|1.766510|2.520032|2.817994|2.158146|1.493939|1.370211|1.377851|2.036451|0.058089|0.057427|0.058948|0.075424|0.076290|0.098380|0.216165|0.500000|
|1.925400|3.930683|2.498500|3.044738|5.380632|4.927008|4.940198|5.626784|8.909453|17.700889|8.898977|5.650561|6.958678|7.098132|3.903982|6.254799|4.450963|4.415339|2.840975|2.609047|2.300945|2.207322|3.181984|3.609640|2.650247|1.820503|1.644367|1.648990|2.464827|0.052278|0.049885|0.052130|0.068256|0.067262|0.092786|0.124027|0.215337|0.500000|
|2.759207|5.695334|4.085307|4.834884|7.094409|10.049918|8.899583|5.633126|4.980961|5.666546|8.954212|17.699152|7.091254|8.392083|6.325808|12.852594|6.332151|5.080986|3.065753|2.573417|2.243712|2.243307|3.434564|4.093399|2.660118|1.868536|1.653193|1.612927|2.396579|0.077570|0.067526|0.074547|0.121340|0.109862|0.237965|0.123960|0.107990|0.124351|0.500000|
|2.019092|3.999875|2.657825|3.010050|4.851448|5.196528|4.663322|3.972553|4.270884|5.784184|8.873122|6.942221|17.650940|12.657173|7.471971|13.759714|6.616887|5.625722|3.622716|2.981129|2.639464|2.710707|4.246365|5.050016|3.190786|2.250835|1.958107|1.889708|2.818002|0.056425|0.050979|0.055512|0.076360|0.073760|0.110870|0.090538|0.098502|0.147839|0.203504|0.500000|
|1.827543|3.637302|2.348126|2.711219|4.550868|4.503558|4.185735|3.970544|4.768438|7.281092|8.900185|5.618933|17.586705|12.594826|5.866707|9.074971|5.953084|5.717308|3.735897|3.216298|2.826332|2.808951|4.230500|4.940526|3.294005|2.272167|1.993877|1.962575|2.957345|0.050636|0.046886|0.049878|0.066312|0.064214|0.091333|0.090502|0.113230|0.221908|0.142410|0.303136|0.500000|
|1.857495|3.687873|2.356059|2.678519|4.447344|4.429160|3.927192|3.606524|4.023533|5.314711|6.529390|5.116254|8.996191|26.103422|9.465806|10.873864|10.576689|11.270983|5.994937|4.761254|3.738761|3.514663|5.317955|6.907575|3.857381|2.544780|2.189458|2.196541|3.428765|0.052409|0.047819|0.049697|0.068591|0.062477|0.091747|0.084273|0.096764|0.147002|0.138556|0.180484|0.221317|0.500000|
|1.876828|3.588482|2.286855|2.402265|3.851661|3.863124|2.996564|2.595861|2.597536|2.982088|3.636401|3.643877|4.321202|8.253741|9.619212|14.240106|25.936864|12.825078|7.332778|4.839315|3.931600|4.043616|6.878216|10.240940|4.338428|2.932345|2.435885|2.364467|3.671341|0.054827|0.047987|0.050190|0.069874|0.060897|0.086094|0.064129|0.064038|0.078637|0.115331|0.119049|0.103608|0.155997|0.500000|
|1.750508|3.395254|2.106938|2.281844|3.785452|3.584342|2.876367|2.640438|2.733414|3.120375|3.530432|3.343097|3.969667|7.669827|6.130065|8.161297|13.160247|25.983027|9.447610|7.331353|4.875611|4.196696|6.122321|8.365641|4.373806|2.762269|2.362194|2.425996|3.907366|0.050475|0.045555|0.046207|0.062938|0.055014|0.075903|0.065668|0.068877|0.084713|0.096221|0.098627|0.101217|0.184862|0.208129|0.500000|
|1.434236|2.751533|1.674507|1.805884|3.070131|2.754489|2.216488|2.127399|2.270098|2.576319|2.739225|2.500773|3.110226|5.371919|3.851191|5.589935|6.448143|9.763375|8.773751|17.727343|8.972387|5.684339|6.836049|7.773799|5.698775|3.287630|2.842802|3.107090|5.359142|0.040933|0.037810|0.038207|0.048949|0.044332|0.057239|0.053883|0.059370|0.073689|0.069954|0.078278|0.086242|0.129829|0.119128|0.213082|0.500000|
|1.229472|2.325087|1.405762|1.492382|2.545494|2.244478|1.779888|1.715820|1.824931|2.049631|2.161464|1.987571|2.472263|3.981237|2.900370|4.496996|4.520527|5.702986|5.659218|8.928274|17.797689|8.802087|7.785893|6.817992|9.691074|4.729680|4.150347|5.064320|10.477832|0.035042|0.032536|0.033085|0.040853|0.037753|0.046798|0.043977|0.048337|0.059216|0.056037|0.064897|0.070201|0.089366|0.090188|0.112962|0.211369|0.500000|
|1.197053|2.227127|1.362991|1.413825|2.371764|2.135902|1.660050|1.557432|1.623523|1.828360|2.000173|1.882262|2.359880|3.607891|2.798490|4.752748|4.035381|4.239489|3.929374|3.781083|4.581043|6.896580|10.031812|6.768864|12.289958|17.849623|8.580464|5.865901|8.026940|0.034265|0.031382|0.032774|0.039774|0.037470|0.045530|0.039859|0.042414|0.051881|0.054987|0.067004|0.066079|0.073135|0.087764|0.077705|0.086996|0.113096|0.500000|
|1.023044|1.892748|1.142549|1.181498|2.005636|1.753587|1.355575|1.294473|1.350787|1.492473|1.588046|1.499610|1.808867|2.679814|2.020650|3.447643|2.886789|3.062569|2.683720|2.779431|3.378364|4.184396|5.198771|4.108925|8.058616|8.734101|17.818641|8.501605|7.918249|0.029162|0.027057|0.028046|0.033057|0.031437|0.036989|0.033571|0.035859|0.042639|0.043116|0.050776|0.051291|0.055133|0.061300|0.058494|0.068196|0.093566|0.193950|0.500000|
|0.996160|1.852357|1.110462|1.157316|1.980867|1.709851|1.329856|1.286079|1.352091|1.487377|1.556193|1.458486|1.749463|2.618871|1.935189|3.217383|2.818148|3.117114|2.747000|3.091272|3.958524|4.347085|4.794461|3.916847|8.319132|5.886424|8.489650|17.786893|12.629893|0.028331|0.026485|0.027133|0.032037|0.030296|0.035736|0.033462|0.036204|0.042841|0.041369|0.047886|0.049974|0.055416|0.058516|0.060977|0.077971|0.122686|0.123621|0.193038|0.500000|
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