Version2.1
2020-12-19T03:51:57Z
10.1021/jm300687e
Gaussian16
RevisionB.01
PWARBURT
08-Nov-2020
#N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2)
DUDE c1ccc(cc1)n2c3c(cc(c(=O)[nH]3)C[NH2+]Cc4ccccc4Cl)c(n2)c5ccc(cc5)F C13564711
RHF
6-31G(d)
(6D,7F)
c1ccc(cc1)n2c3c(cc(c(=O)[nH]3)C[NH2+]Cc4ccccc4Cl)c(n2)c5ccc(cc5)F
C01[X(C26H21Cl1F1N4O1)]
156
C1
541
Fc1ccc(cc1)c1nn(c2c1cc(C[NH2+]Cc1ccccc1Cl)c(=O)[nH]2)c1ccccc1
Fc1ccc(cc1)c1nn(c2c1cc(C[NH2+]Cc1ccccc1Cl)c(=O)[nH]2)c1ccccc1
Fc1ccc(cc1)c2nn(c3ccccc3)c4NC(=O)C(=Cc24)C[NH2+]Cc5ccccc5Cl
InChIKey=UUJMZTBFMIEFNO-UHFFFAOYSA-O
InChI=1S/C26H20ClFN4O/c27-23-9-5-4-6-18(23)15-29-16-19-14-22-24(17-10-12-20(28)13-11-17)31-32(25(22)30-26(19)33)21-7-2-1-3-8-21/h1-14,29H,15-16H2,(H,30,33)/p+1
InChI=1/C26H20ClFN4O/c27-23-9-5-4-6-18(23)15-29-16-19-14-22-24(17-10-12-20(28)13-11-17)31-32(25(22)30-26(19)33)21-7-2-1-3-8-21/h1-14,29H,15-16H2,(H,30,33)/p+1/fC26H21ClFN4O/h29-30H/q+1
c1ccc(cc1)n2c3c(cc(c(=O)[nH]3)C[NH2+]Cc4ccccc4Cl)c(n2)c5ccc(cc5)F
C01[X(C26H21Cl1F1N4O1)]
156
C01
541
Fc1ccc(cc1)c1nn(c2c1cc(C[NH2+]Cc1ccccc1Cl)c(=O)[nH]2)c1ccccc1
F[C]1[CH][CH][C]([CH][CH]1)[C]1[N][N@@]([C]2[C]1[CH]=[C]([C](=O)N2)C[NH2]C[C]1[CH][CH][CH][CH][C]1Cl)[C]1[CH][CH][CH][CH][CH]1
F[C]1[CH][CH][C]([CH][CH]1)[C]2[N]N([C]3[CH][CH][CH][CH][CH]3)[C]4NC(=O)C(=C[C]24)C[NH2]C[C]5[CH][CH][CH][CH][C]5Cl
InChIKey=BGPHIRFZDVBCCZ-UHFFFAOYSA-N
InChI=1S/C26H21ClFN4O/c27-23-9-5-4-6-18(23)15-29-16-19-14-22-24(17-10-12-20(28)13-11-17)31-32(25(22)30-26(19)33)21-7-2-1-3-8-21/h1-14H,15-16,29H2,(H,30,33)
InChI=1/C26H21ClFN4O/c27-23-9-5-4-6-18(23)15-29-16-19-14-22-24(17-10-12-20(28)13-11-17)31-32(25(22)30-26(19)33)21-7-2-1-3-8-21/h1-14H,15-16,29H2,(H,30,33)/f/h30H
3185.9083216518
-1848.2093993
1-A
22883.7955
119
422
541
|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|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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10.14976
10.0799 -2.8358 -2.2190
10.7037
|XX|YY|ZZ|XY|XZ|YZ|
-96.3623 -165.7234 -179.5777 15.5455 -3.2657 -4.7516
|XX|YY|ZZ|XY|XZ|YZ|
50.8589 -18.5023 -32.3565 15.5455 -3.2657 -4.7516
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ|
504.2445 -142.1362 0.4592 -79.8206 -140.1152 40.1204 36.5231 -3.5546 11.7094 25.2816
|XXXX|YYYY|ZZZZ|XXXY|XXXZ|YYYX|YYYZ|ZZZX|ZZZY|XXYY|XXZZ|YYZZ|XXYZ|YYXZ|ZZXY|
-16588.2950 -7674.0678 -1132.7940 -763.0764 573.3852 792.1776 24.2175 -43.7251 -0.4446 -4522.2386 -3299.9390 -1500.7160 -181.6208 -101.8657 71.0776
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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 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156
|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|
13.7020 19.5902 24.2954 35.7348 39.2562 45.4179 55.1878 59.7021 69.9628 99.0330 115.9129 137.6934 155.1080 181.3572 195.0886 214.8652 232.7729 241.6929 260.5222 288.4154 299.6917 311.2639 323.1279 348.2889 382.0496 393.6859 411.7462 438.1408 448.0793 458.4395 463.8703 468.2064 482.1343 500.7270 518.3121 527.6501 552.6636 569.9585 584.5648 600.6988 651.2455 662.1718 664.0455 676.7706 694.5532 712.0626 728.2880 740.5131 755.2936 764.7270 778.0997 783.6534 798.6013 805.8127 849.2222 861.9728 863.2624 877.5852 885.7912 895.6960 903.5094 935.4927 936.6787 954.8251 959.3566 980.5507 996.9044 1007.8285 1049.8440 1065.4962 1076.2350 1084.4430 1091.0883 1095.9099 1098.6107 1105.1132 1108.8360 1115.0548 1122.7413 1132.4054 1134.4951 1140.2516 1143.6022 1151.8274 1163.1645 1181.8559 1191.9450 1203.5495 1219.6079 1226.0794 1233.1614 1250.0365 1282.6898 1286.4524 1288.4483 1295.9859 1297.8013 1328.0189 1335.0552 1343.9709 1344.6669 1400.8697 1412.2439 1421.2837 1432.0769 1441.4777 1460.6932 1471.3295 1479.3711 1489.9920 1535.6621 1545.6398 1558.0911 1567.0243 1594.2682 1606.0286 1614.4515 1622.7116 1634.4532 1649.4283 1652.3684 1664.9237 1679.1308 1712.3637 1717.2780 1771.6763 1774.7344 1789.7220 1795.5039 1796.5531 1804.4788 1810.5680 1822.2357 1836.6041 1882.6343 3266.6751 3287.6570 3329.2594 3346.4167 3368.9499 3369.1822 3371.2243 3379.4966 3382.6259 3390.0955 3390.3808 3398.5812 3400.6246 3404.9371 3406.2051 3409.1675 3413.2471 3414.3216 3561.4997 3711.8944 3823.6380
7.5160 8.5303 6.3344 4.2083 4.8180 5.6164 6.0195 5.7439 7.3802 5.6999 5.1349 6.5507 5.8220 5.5479 3.1470 5.7997 4.2963 6.0104 5.5621 3.8985 5.9547 5.3723 4.3830 5.8044 6.3604 6.2460 4.7109 4.9863 5.7938 2.9561 3.2734 3.3117 4.0709 5.1764 4.3336 5.5224 4.4114 5.6689 4.2836 3.3655 4.6574 5.3944 6.0065 6.2667 7.1884 1.3726 4.6722 5.9506 4.8908 3.7955 3.6716 4.8120 4.0191 4.1127 6.1871 1.3183 1.5848 4.5408 1.3955 4.0961 5.3400 1.2812 3.7231 1.2462 1.6636 4.6327 1.3915 1.6313 1.4013 4.1521 1.3751 2.1716 5.6101 5.4711 1.5306 1.4140 1.3743 2.4458 2.1119 2.1012 3.0850 1.3416 1.3577 2.0711 2.7507 1.7334 1.6601 3.8425 2.7070 3.4448 2.3592 1.5700 1.2792 2.2564 2.1728 1.1556 1.9675 2.2304 2.2975 1.7484 1.5662 3.8999 1.8704 2.8652 1.7903 1.4374 1.4860 1.4597 1.6553 1.6955 1.6281 1.4518 1.9013 1.8513 1.9732 1.8456 2.0542 2.1779 1.1434 1.2380 1.9411 3.1800 3.0330 5.5765 4.8507 6.7774 5.5016 5.7551 6.9547 5.6429 5.5497 6.8312 5.8131 1.0808 6.3970 1.0609 1.0607 1.1103 1.1112 1.0899 1.0908 1.0914 1.0904 1.0935 1.0936 1.0912 1.0908 1.0969 1.0958 1.0957 1.0977 1.0970 1.0978 1.0691 1.0846 1.0793
0.0008 0.0019 0.0022 0.0032 0.0044 0.0068 0.0108 0.0121 0.0213 0.0329 0.0406 0.0732 0.0825 0.1075 0.0706 0.1578 0.1372 0.2069 0.2224 0.1911 0.3151 0.3067 0.2696 0.4148 0.5470 0.5704 0.4706 0.5640 0.6854 0.3660 0.4150 0.4277 0.5575 0.7647 0.6859 0.9059 0.7939 1.0850 0.8624 0.7155 1.1638 1.3936 1.5605 1.6911 2.0431 0.4101 1.4601 1.9225 1.6439 1.3078 1.3097 1.7411 1.5102 1.5734 2.6290 0.5771 0.6958 2.0604 0.6451 1.9362 2.5684 0.6606 1.9246 0.6694 0.9021 2.6244 0.8148 0.9762 0.9100 2.7773 0.9384 1.5047 3.9350 3.8714 1.0885 1.0174 0.9955 1.7917 1.5685 1.5875 2.3394 1.0277 1.0462 1.6189 2.1926 1.4266 1.3896 3.2794 2.3724 3.0511 2.1137 1.4454 1.2400 2.2002 2.1252 1.1435 1.9525 2.3176 2.4127 1.8607 1.6685 4.5091 2.1979 3.4100 2.1632 1.7598 1.8680 1.8617 2.1345 2.2178 2.2621 2.0435 2.7195 2.6784 2.9550 2.8047 3.1546 3.3788 1.7997 1.9844 3.1226 5.1936 5.0383 9.6339 8.4282 12.5337 10.2095 10.8611 13.2099 10.7308 10.6470 13.1940 11.3728 2.1481 13.3585 6.6702 6.7550 7.2507 7.3313 7.2882 7.2950 7.3081 7.3371 7.3719 7.4053 7.3900 7.4235 7.4740 7.4849 7.4901 7.5165 7.5298 7.5404 7.9899 8.8045 9.2974
0.3401 0.4097 0.4356 0.4730 0.3811 0.6328 0.6770 0.6801 2.2336 0.4681 2.6148 1.4145 0.2778 1.1844 2.7793 6.9367 8.7371 5.9067 2.8219 2.4868 1.6401 5.9872 7.7165 8.9825 27.0738 5.4436 2.2965 13.4913 2.8448 0.5551 7.9460 5.3559 3.2020 3.5911 31.9332 6.4393 14.0378 11.4311 2.5698 30.4352 12.7645 14.6877 17.8752 3.6746 1.1489 46.9106 20.2424 11.6263 23.9475 8.6969 35.0187 4.6395 11.5590 1.6945 7.9606 56.4334 36.5308 78.7283 34.5739 33.9110 6.0243 2.4781 50.7935 0.9220 66.1669 18.0429 1.3971 4.6298 3.3373 68.1424 3.4612 25.5999 2.6703 22.9485 3.4302 2.4523 0.0772 4.5846 3.4879 0.8551 9.8433 0.0156 0.1204 10.0686 58.9327 2.1391 5.7529 30.7291 34.5456 3.9155 15.1216 13.8827 28.7672 1.4558 45.6793 0.3357 23.4101 4.6751 20.2258 7.7998 2.5140 163.0473 114.5429 73.1392 85.5627 6.5135 56.7580 22.0385 45.4302 59.6960 88.3643 16.0836 8.5939 11.5193 453.8891 323.3418 22.5522 12.0749 1.9213 16.1793 23.7990 86.7681 38.5612 110.4452 252.5209 77.6521 2.1074 7.5637 97.4309 13.4999 138.4873 176.1591 140.2312 27.4132 1131.8888 8.8883 6.5337 2.7389 1.9379 6.3965 17.2912 4.3752 0.7886 4.8795 12.1808 2.7748 2.5949 15.1106 4.3726 3.2406 2.6172 1.4947 2.1476 198.8699 75.4170 121.6287
1.2735 3.5147 3.8630 7.6723 6.1641 5.0923 2.6501 3.0967 2.2365 0.4023 6.2119 0.5326 3.7393 0.2684 1.4194 3.3870 1.4547 3.1340 0.9334 1.1729 0.9588 2.5020 0.9531 1.8928 1.3478 1.4202 3.7738 0.8793 1.2134 0.7055 2.3591 2.3729 4.5145 0.1216 2.7740 1.3948 3.3839 1.1339 2.7003 3.5760 4.0384 1.7952 0.7916 4.1793 6.4999 2.1103 4.2507 7.2374 1.6175 1.5554 2.5586 25.8695 1.5982 0.3179 1.2986 0.8290 1.9115 2.5886 0.7963 4.3190 22.9803 3.9738 3.9876 3.5662 1.6905 3.7115 2.8983 0.7055 2.0918 4.6920 3.3046 22.4987 58.0536 4.7795 5.0374 1.2874 0.1585 1.6935 24.5805 2.2701 11.8410 0.4172 0.1632 20.4164 9.1043 2.4001 5.4480 15.5383 9.7508 7.5220 21.5005 3.0586 3.6475 13.2701 21.4411 4.8862 52.6492 13.5347 58.0354 15.9870 27.0166 9.1407 36.7250 13.2399 61.6675 16.7861 9.4104 10.9440 1.5079 9.6216 12.1234 42.4540 22.9365 19.2258 30.8456 51.6116 4.1071 2.4072 2.6140 14.1060 4.5018 36.1512 39.4559 103.3088 121.9449 87.8209 9.4819 16.9802 26.3197 45.2421 106.3865 78.0827 265.1217 29.1848 22.0607 74.2966 78.4504 30.6530 32.6280 27.7508 46.7335 56.7538 78.0303 50.6940 92.8634 74.1433 56.8566 147.3514 118.2425 121.7229 180.9567 144.6543 190.3916 33.8605 14.3200 54.0914
0.7472 0.7451 0.7383 0.7224 0.7142 0.7446 0.7251 0.7395 0.7149 0.7184 0.7353 0.7485 0.6163 0.1866 0.6147 0.2690 0.3303 0.4634 0.5769 0.7170 0.7442 0.7500 0.7124 0.7247 0.6896 0.6158 0.3619 0.6918 0.6580 0.2455 0.7460 0.5322 0.2988 0.7439 0.2268 0.4800 0.2300 0.5731 0.3944 0.2074 0.6488 0.2169 0.7473 0.7162 0.7439 0.7463 0.5977 0.2668 0.7481 0.6666 0.3786 0.1115 0.6735 0.7197 0.5049 0.7332 0.1716 0.5303 0.2213 0.2800 0.1070 0.4975 0.3212 0.4923 0.3192 0.7403 0.4811 0.7226 0.7376 0.3301 0.3328 0.1322 0.0913 0.4384 0.4861 0.3170 0.3864 0.1934 0.3212 0.7388 0.2318 0.4468 0.3988 0.1314 0.3604 0.2175 0.6825 0.4460 0.1246 0.7303 0.5787 0.4170 0.2620 0.2634 0.3432 0.2413 0.3015 0.1300 0.2215 0.2561 0.1799 0.1030 0.0905 0.5703 0.2465 0.5795 0.6373 0.2422 0.7400 0.5173 0.4258 0.6630 0.7245 0.1861 0.7150 0.6850 0.4258 0.7380 0.7455 0.7335 0.7123 0.2242 0.5520 0.4677 0.2032 0.3137 0.6268 0.2197 0.2111 0.5936 0.5266 0.3786 0.3819 0.3762 0.1978 0.1033 0.0273 0.7311 0.7463 0.6503 0.6407 0.4401 0.6971 0.2800 0.7463 0.7448 0.6283 0.1728 0.3501 0.2627 0.1150 0.1774 0.1232 0.1710 0.3504 0.2486
0.8553 0.8540 0.8495 0.8389 0.8333 0.8536 0.8407 0.8502 0.8337 0.8361 0.8474 0.8562 0.7626 0.3145 0.7614 0.4240 0.4966 0.6333 0.7317 0.8352 0.8533 0.8571 0.8320 0.8404 0.8163 0.7622 0.5314 0.8178 0.7938 0.3942 0.8545 0.6947 0.4602 0.8531 0.3698 0.6487 0.3740 0.7286 0.5657 0.3435 0.7870 0.3565 0.8554 0.8346 0.8531 0.8548 0.7482 0.4213 0.8559 0.8000 0.5492 0.2007 0.8049 0.8370 0.6710 0.8461 0.2929 0.6930 0.3624 0.4375 0.1932 0.6644 0.4863 0.6598 0.4839 0.8508 0.6496 0.8390 0.8490 0.4963 0.4994 0.2336 0.1673 0.6096 0.6542 0.4814 0.5574 0.3242 0.4863 0.8498 0.3764 0.6176 0.5702 0.2323 0.5298 0.3573 0.8113 0.6169 0.2216 0.8441 0.7331 0.5886 0.4152 0.4169 0.5110 0.3888 0.4633 0.2301 0.3626 0.4078 0.3049 0.1868 0.1660 0.7264 0.3955 0.7337 0.7785 0.3899 0.8505 0.6818 0.5973 0.7974 0.8402 0.3137 0.8338 0.8130 0.5973 0.8493 0.8542 0.8463 0.8320 0.3662 0.7113 0.6374 0.3378 0.4776 0.7706 0.3602 0.3485 0.7450 0.6899 0.5493 0.5527 0.5467 0.3303 0.1872 0.0531 0.8447 0.8547 0.7881 0.7810 0.6112 0.8215 0.4375 0.8547 0.8538 0.7717 0.2947 0.5186 0.4161 0.2063 0.3014 0.2193 0.2920 0.5189 0.3982
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
6 6 6 6 6 6 7 6 6 6 6 6 8 7 1 6 7 1 1 6 6 6 6 6 6 6 17 6 7 6 6 6 6 6 6 9 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 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 1.00783 12.00000 14.00307 1.00783 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 34.96885 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 18.99840 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
13349.5537 30969.0816 41560.0001
0.99995 0.00891 -0.00333 -0.00893 0.99995 -0.00477 0.00328 0.00480 0.99998
1
0.00649 0.00280 0.00208
0.13519 0.05828 0.04342
19.71 28.19 34.96 51.41 56.48 65.35 79.40 85.90 100.66 142.49 166.77 198.11 223.17 260.93 280.69 309.14 334.91 347.74 374.83 414.97 431.19 447.84 464.91 501.11 549.68 566.43 592.41 630.39 644.69 659.59 667.41 673.64 693.68 720.43 745.74 759.17 795.16 820.04 841.06 864.27 937.00 952.72 955.41 973.72 999.31 1024.50 1047.84 1065.43 1086.70 1100.27 1119.51 1127.50 1149.01 1159.38 1221.84 1240.19 1242.04 1262.65 1274.46 1288.71 1299.95 1345.97 1347.67 1373.78 1380.30 1410.79 1434.32 1450.04 1510.49 1533.01 1548.46 1560.27 1569.83 1576.77 1580.66 1590.01 1595.37 1604.32 1615.37 1629.28 1632.29 1640.57 1645.39 1657.22 1673.53 1700.43 1714.94 1731.64 1754.74 1764.05 1774.24 1798.52 1845.50 1850.92 1853.79 1864.63 1867.25 1910.72 1920.85 1933.67 1934.68 2015.54 2031.90 2044.91 2060.44 2073.96 2101.61 2116.91 2128.49 2143.77 2209.48 2223.83 2241.75 2254.60 2293.80 2310.72 2322.84 2334.72 2351.61 2373.16 2377.39 2395.45 2415.89 2463.71 2470.78 2549.05 2553.45 2575.01 2583.33 2584.84 2596.24 2605.00 2621.79 2642.46 2708.69 4700.02 4730.21 4790.06 4814.75 4847.17 4847.50 4850.44 4862.34 4866.84 4877.59 4878.00 4889.80 4892.74 4898.95 4900.77 4905.03 4910.90 4912.45 5124.20 5340.59 5501.36
0.458266
0.483424
0.484368
0.398277
-1847.751133
-1847.725975
-1847.725031
-1847.811122
2.887506D-04
MUNgauss
RevisionA2.0
retrievium
19-Dec-2020
DUDE c1ccc(cc1)n2c3c(cc(c(=O)[nH]3)C[NH2+]Cc4ccccc4Cl)c(n2)c5ccc(cc5)F C13564711
RHF
6-31G(d)
(6D,10F)
C1
459.138792
|X|Y|Z|
124.849094 79.896379 30.216201
67.047736
30
|36.858105|
|13.727049|36.858105|
|7.925163|13.774436|36.858105|
|6.906666|7.981245|13.747851|36.858105|
|7.936639|6.867907|7.896197|13.755379|36.858105|
|13.763083|7.933312|6.852812|7.964014|13.737905|36.858105|
|4.553332|5.165499|7.855592|13.362748|7.838750|5.153801|53.358707|
|3.725256|4.017082|5.389629|7.681565|6.086970|4.279805|19.573987|36.858105|
|3.009175|3.274150|4.231585|5.300935|4.361754|3.331401|11.802921|13.795590|36.858105|
|2.536448|2.691149|3.285758|3.933899|3.496391|2.802354|7.379051|7.948101|13.485856|36.858105|
|2.500261|2.590646|3.075333|3.687543|3.440779|2.797863|6.406282|6.957256|7.949969|14.020469|36.858105|
|2.891714|2.940430|3.473158|4.298266|4.146655|3.317196|7.120978|8.012736|6.769235|7.759147|13.061513|36.858105|
|2.707283|2.692279|3.052026|3.644218|3.676057|3.093444|5.562666|5.469817|4.727695|5.342678|8.113312|15.662351|73.516695|
|3.616593|3.709665|4.592682|6.209573|5.791789|4.261804|10.720318|14.035306|7.929967|6.844942|7.902819|13.902178|15.062366|53.358707|
|4.120416|4.084840|4.886238|6.627299|6.753855|5.004811|9.536573|9.221451|5.755693|5.035943|5.751051|9.382642|13.828014|25.929045|0.500000|
|2.115359|2.164465|2.482562|2.871932|2.760473|2.341312|4.679019|4.502441|5.009244|7.560007|12.696520|7.628924|12.211852|6.928422|0.117022|36.858105|
|2.020010|2.068244|2.333839|2.626143|2.528168|2.200816|4.115853|3.818806|4.001144|5.288857|7.706079|6.462072|12.333186|6.081239|0.108781|12.677449|53.358707|
|2.011683|2.090863|2.374059|2.627510|2.473855|2.159342|4.140834|3.809275|4.068973|5.323883|7.083588|5.852685|10.457117|5.863519|0.104640|9.210116|25.695480|0.500000|
|2.165338|2.197759|2.467391|2.795340|2.726969|2.376624|4.305088|4.020641|3.968867|4.948591|7.415268|7.640523|17.352075|6.841098|0.125362|9.387794|25.492300|0.325057|0.500000|
|1.759773|1.786318|1.975445|2.187473|2.138362|1.904759|3.339426|2.955737|3.087251|3.870597|4.962210|4.403711|8.659937|4.565766|0.085063|7.521466|17.293049|0.256149|0.254056|36.858105|
|1.672950|1.699445|1.854992|2.014125|1.968966|1.786869|3.005189|2.594134|2.647100|3.148513|3.849861|3.670605|7.388159|4.003248|0.076894|4.945622|10.452699|0.199333|0.195407|12.646220|36.858105|
|1.633066|1.638840|1.762808|1.909149|1.898280|1.747119|2.788815|2.370877|2.357316|2.714191|3.288127|3.314164|6.923346|3.703562|0.073110|3.999829|7.537493|0.139576|0.159681|7.599595|13.712813|36.858105|
|1.535954|1.542947|1.642014|1.751063|1.739025|1.623861|2.521726|2.101617|2.076659|2.330240|2.731344|2.787694|5.705875|3.239036|0.064898|3.153944|5.595080|0.110238|0.118998|5.027938|7.888984|13.757831|36.858105|
|1.481536|1.504061|1.603060|1.689152|1.655723|1.548615|2.437553|2.016325|2.012449|2.247211|2.574697|2.583965|5.122986|3.051468|0.060832|2.921295|5.137330|0.107154|0.105926|4.436772|6.834097|7.957054|13.771690|36.858105|
|1.510028|1.549509|1.670199|1.758815|1.700165|1.574644|2.575127|2.145436|2.180728|2.471401|2.813360|2.737575|5.292906|3.207933|0.062877|3.226725|5.812665|0.127862|0.114366|5.000435|7.870137|6.877697|7.930285|13.740682|36.858105|
|1.602031|1.646452|1.797289|1.918769|1.848059|1.686419|2.860340|2.433208|2.510942|2.941911|3.431802|3.230603|6.223898|3.656742|0.070263|4.148557|8.090863|0.181490|0.149049|7.507945|13.678570|7.987543|6.906933|7.983343|13.807584|36.858105|
|1.600836|1.669919|1.847872|1.963454|1.852822|1.674625|2.986863|2.541614|2.726410|3.254301|3.624437|3.205704|5.796336|3.680537|0.069113|4.319330|7.743492|0.196231|0.131881|6.189487|6.982459|4.754502|4.225012|4.775962|7.067711|10.879707|448.794386|
|3.069762|3.450298|4.575280|5.451715|4.245684|3.299089|12.094077|8.605880|13.262118|7.158073|4.997593|4.536919|6.263749|7.348973|0.123843|3.690985|4.221159|0.088481|0.085114|2.527532|2.226343|2.008724|1.805437|1.767632|1.908185|2.151443|18.874096|36.858105|
|3.788315|4.409720|6.356099|7.842912|5.400746|4.044764|18.978445|8.627629|8.512585|5.234930|4.178395|4.184529|5.954269|7.337813|0.131781|3.168364|3.756957|0.078155|0.077768|2.281598|2.050441|1.885500|1.713030|1.673049|1.783120|1.978975|16.978417|14.746413|53.358707|
|2.559809|2.859661|3.579488|3.948230|3.261174|2.687000|7.279214|5.201010|7.264974|5.582881|4.020464|3.511281|5.100795|5.255379|0.092382|3.238514|3.739934|0.079025|0.073628|2.315523|2.048600|1.840799|1.666145|1.646414|1.788018|2.007360|17.970776|12.898651|10.723082|36.858105|
|2.471853|2.737715|3.326914|3.593952|3.056252|2.577603|6.117884|4.117364|5.049213|4.112386|3.209399|2.907095|4.360673|4.362901|0.079523|2.695064|3.157965|0.065858|0.062638|2.009564|1.795625|1.636990|1.493636|1.473121|1.583793|1.756456|15.506053|7.662775|8.797388|13.677959|36.858105|
|2.116893|2.323268|2.723863|2.861793|2.506049|2.181345|4.625733|3.206395|3.834689|3.383145|2.731366|2.460014|3.781437|3.582231|0.066236|2.391465|2.843378|0.059488|0.055906|1.848947|1.663770|1.517322|1.393105|1.381949|1.488341|1.641356|14.597101|5.067428|6.032412|7.902237|13.790113|36.858105|
|1.920621|2.105970|2.451424|2.556463|2.248034|1.971359|4.129826|2.975448|3.628453|3.371944|2.720730|2.395722|3.704292|3.397339|0.062510|2.432864|2.912842|0.061659|0.056480|1.905670|1.716381|1.549731|1.424115|1.423832|1.548321|1.712018|15.525507|4.500742|5.158776|6.912785|8.016870|13.803639|36.858105|
|1.954044|2.152055|2.536092|2.661373|2.315193|2.011142|4.408572|3.293264|4.200482|4.019468|3.144720|2.686628|4.107250|3.749335|0.067855|2.796256|3.336486|0.071757|0.063870|2.153192|1.927577|1.714523|1.567422|1.574955|1.733584|1.936790|17.956698|5.054507|5.434646|7.892694|6.858287|7.891696|13.822210|36.858105|
|2.224786|2.471136|3.004121|3.222875|2.730761|2.311110|5.647496|4.308987|5.988553|5.444459|3.944396|3.302611|4.881744|4.676477|0.082397|3.316483|3.875791|0.083738|0.074458|2.417008|2.139346|1.891656|1.713623|1.712572|1.887820|2.131639|19.703487|7.634541|7.214021|13.697830|7.941550|6.870322|8.025800|13.767820|36.858105|
|1.707712|1.857068|2.114034|2.179241|1.951404|1.742764|3.414916|2.467162|2.909002|2.777845|2.324605|2.068313|3.259944|2.900496|0.054091|2.136535|2.598465|0.054912|0.050341|1.733483|1.575641|1.429501|1.322643|1.327124|1.440304|1.579881|14.309407|3.429005|4.100477|4.670634|5.320192|8.179277|14.399975|8.189576|5.323350|97.533100|
|17.731590|8.912078|5.643927|4.970573|5.646794|8.924587|4.931284|3.087779|2.573930|2.224021|2.208576|2.528031|4.290974|4.151237|0.095642|1.907997|2.504103|0.050857|0.054697|1.624988|1.558182|1.532873|1.453417|1.403092|1.421513|1.495689|11.933214|2.619970|4.265555|2.245123|2.189638|1.911045|1.745050|1.767149|1.982056|3.532321|0.500000|
|8.907571|17.732956|8.946630|5.668222|4.950606|5.645170|5.696777|3.391147|2.881012|2.415874|2.321766|2.586628|4.258028|4.288018|0.094635|1.973144|2.593887|0.053890|0.055917|1.662658|1.596794|1.541491|1.464079|1.437609|1.481421|1.561465|12.750630|3.065463|5.166133|2.630161|2.540918|2.200202|2.010422|2.047171|2.314933|4.029588|0.214897|0.500000|
|5.631475|8.883102|17.747851|8.931231|5.636754|4.944013|9.846821|5.145764|4.317439|3.330105|3.039863|3.316623|5.141012|5.771566|0.119674|2.459091|3.158152|0.066564|0.067297|1.962351|1.847753|1.739178|1.624786|1.602211|1.684806|1.812559|15.191798|4.892753|9.211824|3.902833|3.580027|2.929758|2.652888|2.764195|3.293172|5.111823|0.123915|0.214400|0.500000|
|5.642276|4.950035|5.628145|8.903975|17.712762|8.894772|9.775820|6.326561|4.555073|3.737442|3.743286|4.567621|7.165365|8.597015|0.200683|2.995136|3.650928|0.071580|0.080542|2.266149|2.054824|1.983629|1.796739|1.693539|1.735014|1.901635|15.222388|4.244339|6.920015|3.263342|3.052820|2.505138|2.250110|2.319449|2.736414|4.394930|0.124095|0.107499|0.124125|0.500000|
|8.912043|5.641929|4.942707|5.660491|8.929167|17.731982|5.685323|3.680692|2.952254|2.563464|2.601627|3.078874|5.242628|5.162786|0.123384|2.226377|2.857313|0.056652|0.063126|1.841834|1.731132|1.710780|1.592397|1.508097|1.520532|1.622927|12.806395|2.883800|4.627955|2.403330|2.325358|1.998369|1.814890|1.844491|2.094065|3.644674|0.214883|0.124087|0.107393|0.214927|0.500000|
|2.251652|2.391841|2.868199|3.317091|2.974173|2.451365|5.952957|5.645642|8.813254|17.709104|9.001552|5.546208|7.600238|6.720137|0.108921|6.926411|6.646700|0.138947|0.120612|3.780757|3.054533|2.599439|2.240053|2.181763|2.426377|2.900428|26.714709|6.305990|6.173748|5.784539|4.244086|3.616227|3.747735|4.644766|6.259811|6.915936|0.055552|0.060593|0.081873|0.087575|0.062881|0.500000|
|2.067644|2.078821|2.349841|2.738158|2.713416|2.317492|4.355268|4.082880|4.344951|5.945466|8.864840|6.816869|11.976558|6.408998|0.112135|17.609125|12.511629|0.181600|0.224520|7.129776|4.679684|4.011489|3.122870|2.808354|3.002760|3.765987|29.761649|3.320175|3.982129|2.929100|2.512470|2.240431|2.250528|2.523704|2.931472|4.490826|0.052081|0.052498|0.063728|0.083418|0.062163|0.152578|0.500000|
|1.950769|2.011843|2.304901|2.623337|2.493133|2.133234|4.286379|3.975111|4.683354|7.156975|8.853378|5.556072|8.826398|5.694311|0.097709|17.631841|12.339554|0.221675|0.181872|6.862501|4.594342|3.641737|2.933874|2.782474|3.136724|4.048016|36.464021|3.607104|4.116586|3.320473|2.757653|2.491223|2.588620|3.022190|3.533423|5.133468|0.049111|0.051406|0.064255|0.074378|0.056301|0.216282|0.300646|0.500000|
|1.751012|1.755779|1.927945|2.153166|2.143627|1.914441|3.256713|2.867743|2.946937|3.633869|4.677781|4.311722|8.758745|4.481960|0.084511|6.970544|12.454507|0.181214|0.222746|17.647399|8.894165|7.328230|4.788694|3.991274|4.182671|5.583373|36.979287|2.423608|3.007876|2.212125|1.945016|1.787242|1.822993|2.030539|2.269584|3.739633|0.045026|0.045217|0.052642|0.063902|0.051944|0.097627|0.218273|0.169961|0.500000|
|1.661041|1.695766|1.880022|2.070942|2.008323|1.788578|3.186987|2.791176|3.006695|3.818623|4.620872|3.878966|7.191387|4.156627|0.076764|7.012325|12.416817|0.219401|0.180036|17.641626|8.816415|5.761304|4.243451|3.960748|4.624398|6.832560|54.101877|2.499217|3.028600|2.343703|2.035340|1.893850|1.976513|2.248067|2.493253|4.065969|0.042649|0.044027|0.052281|0.058974|0.047943|0.108625|0.179606|0.210056|0.301412|0.500000|
|1.661455|1.650281|1.769051|1.934211|1.950520|1.795601|2.813095|2.394252|2.357042|2.705419|3.314316|3.404423|7.295661|3.784159|0.075213|4.045759|7.219750|0.126473|0.158599|7.072261|8.925409|17.712631|8.939363|5.659275|4.954108|5.664942|31.455509|2.002744|2.570803|1.825243|1.632444|1.508024|1.528454|1.678413|1.854086|3.168715|0.043345|0.042895|0.048052|0.057215|0.049234|0.071427|0.118663|0.100218|0.225865|0.148165|0.500000|
|1.493116|1.488529|1.569205|1.669757|1.674368|1.578607|2.376990|1.960848|1.918522|2.121717|2.466027|2.558593|5.256322|3.023305|0.061354|2.791846|4.739200|0.092387|0.102477|4.105781|5.630081|8.928406|17.742052|8.913986|5.641778|4.971543|27.393997|1.682182|2.192698|1.552084|1.403308|1.310137|1.332208|1.454054|1.583683|2.791993|0.039481|0.039289|0.042907|0.048067|0.043309|0.056484|0.078182|0.071989|0.114028|0.098164|0.216010|0.500000|
|1.407041|1.427753|1.509868|1.577001|1.547564|1.460802|2.254728|1.841188|1.830255|2.012573|2.267828|2.291816|4.500441|2.763379|0.055541|2.515636|4.258664|0.089176|0.088304|3.549022|4.933296|5.652540|8.915589|17.736809|8.942225|5.673582|31.690609|1.628498|2.113499|1.523849|1.373265|1.293652|1.331739|1.464757|1.582135|2.806772|0.037231|0.038128|0.041957|0.043737|0.039593|0.054359|0.067466|0.066962|0.090821|0.090246|0.124333|0.214461|0.500000|
|1.451984|1.499570|1.614303|1.682515|1.614709|1.501173|2.459271|2.026426|2.071750|2.321589|2.577622|2.492382|4.714865|2.980514|0.058430|2.885414|4.983327|0.112202|0.097403|4.083527|5.623889|4.957494|5.638484|8.883807|17.755691|8.949032|54.347220|1.838330|2.340168|1.739624|1.544406|1.460692|1.528439|1.713562|1.851149|3.215058|0.038052|0.040083|0.045561|0.045452|0.040141|0.063853|0.074007|0.079262|0.096250|0.109509|0.107595|0.123942|0.214762|0.500000|
|2.702065|2.977420|3.616502|3.950583|3.378152|2.835151|6.556215|4.171749|4.777751|3.796167|3.059415|2.865307|4.320559|4.409087|0.081672|2.558460|3.009654|0.062111|0.060497|1.920065|1.721972|1.586799|1.450391|1.422359|1.515594|1.672216|14.520827|7.101536|9.557680|8.917718|17.747865|8.944612|5.683093|4.946736|5.651278|9.624185|0.066086|0.075944|0.105840|0.093512|0.070764|0.104687|0.067316|0.071405|0.052120|0.053507|0.044235|0.038068|0.036915|0.040918|0.500000|
|2.024580|2.203002|2.529187|2.631898|2.347892|2.077594|4.109810|2.816250|3.238549|2.888569|2.405096|2.204563|3.438040|3.211858|0.060296|2.136409|2.563687|0.053308|0.050675|1.687427|1.528112|1.405519|1.296614|1.284497|1.374697|1.505401|13.257920|4.112323|5.191070|5.615792|8.868076|17.748254|8.958130|5.641988|4.953359|16.729486|0.051225|0.058333|0.074767|0.065153|0.053277|0.084621|0.056334|0.061488|0.045610|0.047920|0.038922|0.034043|0.033539|0.037502|0.213542|0.500000|
|1.790695|1.962481|2.279329|2.371617|2.087873|1.835720|3.850123|2.921504|3.640729|3.648012|2.947606|2.508846|3.895692|3.430036|0.062485|2.704593|3.284725|0.071322|0.062258|2.150088|1.937423|1.713026|1.572130|1.592571|1.766491|1.971074|18.599565|4.101026|4.551014|5.610769|4.947137|5.640888|8.962601|17.747298|8.851761|16.748904|0.045338|0.052243|0.068798|0.058116|0.047068|0.118534|0.067535|0.082455|0.055872|0.063077|0.046261|0.040382|0.041189|0.048854|0.107466|0.124613|0.500000|
|2.207409|2.450181|2.978422|3.198097|2.710620|2.294123|5.621944|4.528706|6.447430|6.345512|4.505302|3.646834|5.348277|5.022031|0.087237|3.763083|4.428609|0.098139|0.083914|2.706699|2.387702|2.076967|1.872771|1.882371|2.102194|2.400729|22.714065|7.025451|6.711744|8.887842|5.640568|4.951201|5.694946|8.972451|17.715868|9.644218|0.054644|0.063762|0.090683|0.075457|0.057767|0.208952|0.089320|0.112551|0.069312|0.077789|0.056029|0.047648|0.048012|0.057303|0.124070|0.107543|0.214350|0.500000|
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