Version2.1
2020-12-28T22:26:46Z
10.1021/jm300687e
Gaussian16
RevisionB.01
PWARBURT
15-Nov-2020
#N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2)
DUDE CC(C)S(=O)(=O)c1cc2c(cc1OC)[C@@H]3CO[P@](=O)(NN3CC2)S(=O)(=O)Oc4ccccc4 C39466035
RHF
6-31G(d)
(6D,7F)
CC(C)S(=O)(=O)c1cc2c(cc1OC)[C@@H]3CO[P@](=O)(NN3CC2)S(=O)(=O)Oc4ccccc4
C01[X(C20H25N2O8P1S2)]
168
C1
557
COc1cc2c(cc1S(=O)(=O)C(C)C)CCN1[C@H]2CO[P@](=O)(N1)S(=O)(=O)Oc1ccccc1
COc1cc2c(cc1S(=O)(=O)C(C)C)CCN1[C@H]2CO[P@](=O)(N1)S(=O)(=O)Oc1ccccc1
COc1cc2[C@@H]3CO[P@](=O)(NN3CCc2cc1[S](=O)(=O)C(C)C)[S](=O)(=O)Oc4ccccc4
InChIKey=YYCLNHZFJAVMLN-FZEVHQGJSA-N
InChI=1S/C20H25N2O8PS2/c1-14(2)32(24,25)20-11-15-9-10-22-18(17(15)12-19(20)28-3)13-29-31(23,21-22)33(26,27)30-16-7-5-4-6-8-16/h4-8,11-12,14,18H,9-10,13H2,1-3H3,(H,21,23)/t18-,31+/m0/s1
InChI=1/C20H25N2O8PS2/c1-14(2)32(24,25)20-11-15-9-10-22-18(17(15)12-19(20)28-3)13-29-31(23,21-22)33(26,27)30-16-7-5-4-6-8-16/h4-8,11-12,14,18H,9-10,13H2,1-3H3,(H,21,23)/t18-,31+/m0/s1/f/h21H
CC(C)S(=O)(=O)c1cc2c(cc1OC)[C@@H]3CO[P@](=O)(NN3CC2)S(=O)(=O)Oc4ccccc4
C01[X(C20H25N2O8P1S2)]
168
C01
557
COc1cc2c(cc1S(=O)(=O)C(C)C)CCN1[C@H]2CO[P@](=O)(N1)S(=O)(=O)Oc1ccccc1
CO[C]1[CH][C]2[C]([CH][C]1[S@@]([O])(=O)C(C)C)CC[N@]1[C@H]2CO[P@](=O)(N1)[S@@]([O])(=O)O[C]1[CH][CH][CH][CH][CH]1
CO[C]1[CH][C]2[C]([CH][C]1[S]([O])(=O)C(C)C)CCN3N[P@@](=O)(OC[C@@H]23)[S]([O])(=O)O[C]4[CH][CH][CH][CH][CH]4
InChIKey=YYCLNHZFJAVMLN-FZEVHQGJSA-N
InChI=1S/C20H25N2O8PS2/c1-14(2)32(24,25)20-11-15-9-10-22-18(17(15)12-19(20)28-3)13-29-31(23,21-22)33(26,27)30-16-7-5-4-6-8-16/h4-8,11-12,14,18H,9-10,13H2,1-3H3,(H,21,23)/t18-,31+/m0/s1
InChI=1/C20H25N2O8PS2/c1-14(2)32(24,25)20-11-15-9-10-22-18(17(15)12-19(20)28-3)13-29-31(23,21-22)33(26,27)30-16-7-5-4-6-8-16/h4-8,11-12,14,18H,9-10,13H2,1-3H3,(H,21,23)/t18-,31+/m0/s1/f/h21H
4283.1193402479
-2615.3000446
1-A
22766.0965
135
422
557
|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|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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11.56964
1.7177 5.0595 4.2849
6.8491
|XX|YY|ZZ|XY|XZ|YZ|
-272.2079 -186.4812 -223.9869 -6.5687 11.3308 -0.7532
|XX|YY|ZZ|XY|XZ|YZ|
-44.6492 41.0774 3.5718 -6.5687 11.3308 -0.7532
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ|
-53.5106 2.2786 9.3064 8.1425 218.5923 170.5848 0.2122 35.3606 -11.2125 3.2244
|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 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168
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15.8392 19.1735 21.2380 35.5209 38.6045 45.8057 57.2784 58.6369 70.4426 93.6915 102.9784 116.8685 127.5481 146.5115 160.9640 168.6710 177.3235 199.1417 212.2316 222.5025 227.2406 244.1437 249.3931 260.1811 270.8527 284.1707 285.1202 288.6270 304.3997 321.7068 328.0211 343.8652 352.3336 385.6374 387.5739 392.4688 417.5755 435.3469 448.0881 457.4104 465.8252 475.4470 486.8411 501.6661 518.2241 533.8807 557.0073 575.7415 586.5397 590.3450 609.8992 641.2443 654.9224 660.1308 676.0798 678.9983 732.7909 735.5451 764.6226 765.7416 785.0646 821.4139 827.3928 839.5329 859.7967 864.5154 883.6073 944.5363 951.1145 953.9144 973.1863 982.6384 990.9232 1008.2214 1032.6139 1051.9018 1052.1905 1077.0401 1086.8694 1094.8920 1106.1838 1112.1178 1125.4787 1127.9289 1140.1292 1161.2096 1177.6197 1180.8399 1188.5886 1193.2344 1208.0436 1215.9953 1218.1760 1218.4445 1227.0365 1245.5877 1272.0137 1288.5976 1291.6155 1294.8565 1304.4770 1307.5804 1327.1564 1334.5513 1336.8021 1350.4685 1356.8451 1386.9485 1409.4489 1412.5794 1420.7389 1431.1041 1434.1551 1461.1478 1468.2692 1474.3313 1476.4454 1486.2064 1497.4048 1514.5979 1550.0224 1555.3094 1570.2159 1575.0213 1582.6986 1604.4151 1622.4962 1628.4285 1632.3467 1634.6258 1637.5831 1645.3270 1648.2476 1652.6062 1658.0367 1659.3173 1662.8735 1666.8216 1681.6409 1768.7797 1797.6409 1800.9453 1814.0680 3184.6860 3213.9034 3218.1585 3219.6004 3222.1940 3225.3130 3260.4774 3264.9720 3282.8745 3286.2924 3294.0216 3295.6066 3298.1197 3310.9875 3321.0351 3348.8872 3365.0197 3365.3236 3379.3661 3390.7763 3407.6579 3408.1413 3409.6436 3417.7965 3803.9468
6.6385 4.8430 6.1915 6.1779 5.1398 3.0902 4.2195 2.8890 4.6184 3.6033 7.3675 5.2764 5.0592 5.5392 6.5291 3.3189 4.5330 7.2803 5.4522 2.3077 1.1267 1.8774 1.6943 2.3690 3.2167 2.2007 6.6151 5.5908 5.8283 5.1645 3.5701 3.7124 5.5003 4.7647 4.6162 6.7052 5.9769 5.4654 4.8251 3.6643 2.9776 4.1724 4.4700 4.7962 3.2889 4.8634 7.8096 8.1298 5.0056 3.8165 5.1910 3.6962 4.4448 5.6547 6.5447 4.9364 6.9610 7.9136 5.1926 2.2455 4.4828 4.0418 4.5088 3.5964 2.5767 2.8216 3.2624 3.3012 1.2452 2.6238 1.7398 2.5533 5.8107 3.1048 1.1249 1.4881 1.5002 1.3888 2.5727 6.1525 1.3551 2.7394 1.4711 1.8360 3.6585 2.7908 1.6876 2.0034 3.4960 2.7428 3.9670 2.2583 2.2918 2.9169 4.8032 3.5444 8.0426 1.2409 1.3108 2.8048 2.9501 1.7822 4.2493 1.5323 1.5484 2.0430 1.3314 1.3571 2.1317 2.3337 1.5366 3.8661 3.1658 1.6384 1.3810 1.3761 1.5420 8.3754 1.5388 1.5538 1.5705 1.2562 1.6650 1.2254 1.8395 1.5073 2.1639 1.1125 1.0436 1.3131 1.0483 1.0459 1.0554 1.0958 1.0695 1.0510 1.1040 2.1956 2.5651 8.8392 5.8517 5.2767 5.8011 1.0692 1.0845 1.0638 1.0370 1.0344 1.0373 1.0964 1.1040 1.1023 1.0970 1.1072 1.0969 1.0587 1.0998 1.1022 1.1035 1.1122 1.0877 1.0921 1.0962 1.0966 1.0916 1.0917 1.0958 1.0763
0.0010 0.0010 0.0016 0.0046 0.0045 0.0038 0.0082 0.0059 0.0135 0.0186 0.0460 0.0425 0.0485 0.0701 0.0997 0.0556 0.0840 0.1701 0.1447 0.0673 0.0343 0.0659 0.0621 0.0945 0.1390 0.1047 0.3168 0.2744 0.3182 0.3149 0.2263 0.2586 0.4023 0.4175 0.4085 0.6085 0.6140 0.6103 0.5708 0.4517 0.3807 0.5557 0.6242 0.7112 0.5204 0.8167 1.4276 1.5878 1.0146 0.7837 1.1377 0.8955 1.1233 1.4518 1.7625 1.3409 2.2023 2.5226 1.7887 0.7758 1.6279 1.6068 1.8186 1.4934 1.1223 1.2425 1.5007 1.7353 0.6637 1.4067 0.9708 1.4526 3.3617 1.8595 0.7067 0.9701 0.9786 0.9492 1.7906 4.3456 0.9769 1.9962 1.0979 1.3762 2.8019 2.2172 1.3789 1.6459 2.9099 2.3009 3.4109 1.9675 2.0038 2.5514 4.2609 3.2400 7.6671 1.2140 1.2884 2.7707 2.9578 1.7953 4.4097 1.6080 1.6303 2.1953 1.4442 1.5381 2.4950 2.7435 1.8274 4.6651 3.8364 2.0609 1.7542 1.7624 1.9805 10.8996 2.0329 2.1001 2.2232 1.7904 2.4188 1.7910 2.7148 2.2860 3.3563 1.7382 1.6383 2.0673 1.6563 1.6681 1.6894 1.7633 1.7322 1.7050 1.7987 3.5940 4.2738 16.2934 11.1414 10.0835 11.2479 6.3889 6.6000 6.4913 6.3333 6.3277 6.3574 6.8670 6.9339 6.9996 6.9799 7.0781 7.0194 6.7851 7.1039 7.1627 7.2916 7.4198 7.2582 7.3484 7.4259 7.5028 7.4702 7.4779 7.5416 9.1760
0.2056 0.5162 1.6524 0.7643 3.1148 1.6559 2.4322 1.1076 0.6064 3.1414 3.2344 2.6252 5.5353 2.1971 1.2680 4.4625 1.1561 1.5996 7.5811 0.7277 0.1883 2.7317 5.6933 1.9590 11.5016 5.3336 0.7987 0.1503 9.6729 4.9061 10.3768 8.8576 6.4726 9.8000 13.7442 7.5396 30.9619 4.6500 25.8927 0.2628 0.1102 22.4186 3.8747 7.4150 3.0428 18.8242 278.4088 94.5514 24.5022 40.0156 94.5782 38.1501 36.1077 1.3985 12.7673 83.5015 17.4984 4.9880 27.9815 36.2872 45.7249 52.0237 40.9725 9.5672 62.2089 3.0370 90.8963 59.2583 4.0911 66.8982 63.8453 46.7307 342.1273 33.5333 3.5733 46.0158 3.6313 3.5239 20.0319 1.8956 1.3594 5.3172 2.5284 19.3524 23.3287 74.3755 3.3311 82.2566 182.3628 78.2799 102.0148 4.9189 6.4360 16.7379 88.1569 103.0816 379.1138 15.0513 3.1076 1.7368 14.9915 5.2441 106.4028 0.9861 3.7643 10.9838 20.3128 31.5069 121.1719 51.1156 37.9377 106.3807 276.4744 18.8474 10.0718 10.7480 111.8324 255.7428 48.2953 94.4977 23.7458 0.4438 5.3275 4.1386 50.5079 134.0310 4.9639 9.7305 3.3199 5.9461 1.0529 3.5734 19.3750 2.6813 28.5356 11.4221 5.8665 87.7345 110.4872 51.5657 5.3246 30.9634 122.4345 34.4318 3.9060 20.8892 19.0775 41.4924 30.3657 36.0659 37.7077 30.7704 12.1343 35.2518 9.7682 23.9944 15.9227 12.1073 24.9528 8.2213 0.6770 18.0375 26.4463 1.0795 2.5224 7.8293 1.1656 66.5611
1.2086 0.9640 2.5346 2.6388 1.3557 1.3033 4.0200 0.2106 0.9467 0.4267 0.6921 2.1394 1.1956 0.9639 2.9552 1.3103 0.1754 1.0479 1.2407 1.5984 0.4140 0.5577 0.7683 0.9303 0.3381 0.7484 2.9819 2.4238 4.6452 1.6860 0.9119 2.5249 0.9905 4.2259 1.3437 1.5065 1.1332 3.3469 1.1203 3.1119 0.1573 3.1315 1.9546 2.7986 0.6571 0.3038 1.1625 2.2550 1.3718 5.3424 1.9733 3.5414 4.5974 3.5487 3.9171 0.5896 26.6978 2.3457 2.6512 1.3682 8.3723 4.1218 2.7482 0.6749 6.1269 14.2187 7.5767 6.7510 2.2067 6.2962 0.3941 0.5889 10.6397 3.3561 0.1698 4.5115 5.8341 1.4615 0.9821 28.7253 0.2334 2.3484 1.4150 5.2599 3.0722 0.5232 0.2616 6.1664 13.6279 1.9049 12.0227 7.4340 3.9547 1.4238 7.6229 5.8670 3.1481 5.7298 4.6479 5.4990 2.7802 3.2890 25.0400 5.1312 1.6155 2.9284 6.8251 0.9218 3.8199 9.7175 3.5337 7.1202 11.0691 13.0336 0.5580 5.7461 5.6947 3.9878 11.3276 9.8168 8.4248 1.3475 5.1373 1.1364 1.0374 1.5079 1.0251 16.3109 9.3144 3.6804 15.7122 33.2944 15.9849 5.2067 15.6458 2.4653 9.2081 0.5578 2.3485 20.2076 8.5555 20.7592 55.3349 63.9373 74.0869 82.3816 10.3441 72.2374 244.7840 125.1907 92.7171 46.8428 116.8555 38.4999 42.9866 49.0384 35.6207 44.1599 103.4622 25.5409 52.1288 94.1492 129.2262 84.2406 2.6144 99.1613 84.1606 67.7026
0.7174 0.7240 0.7498 0.7397 0.7481 0.7499 0.7326 0.7441 0.7230 0.7388 0.5403 0.5613 0.7499 0.4660 0.2916 0.3994 0.6955 0.5601 0.7396 0.3679 0.5382 0.7500 0.2953 0.7197 0.6104 0.6981 0.4756 0.7472 0.3154 0.5203 0.4958 0.4982 0.3796 0.1468 0.3433 0.4773 0.6663 0.6446 0.7320 0.6709 0.6689 0.2336 0.5110 0.2775 0.2292 0.7202 0.1595 0.6785 0.6593 0.1805 0.4207 0.5809 0.0444 0.5847 0.7270 0.2209 0.0471 0.7388 0.1231 0.3174 0.1938 0.6498 0.1204 0.6103 0.1219 0.1496 0.0479 0.2424 0.7492 0.7242 0.6891 0.6630 0.5873 0.6941 0.6157 0.6678 0.7470 0.6035 0.2878 0.0860 0.7462 0.7007 0.2381 0.0714 0.3624 0.7101 0.7463 0.3970 0.4371 0.5652 0.2380 0.6402 0.6769 0.4136 0.3038 0.6467 0.7493 0.3041 0.6999 0.5500 0.7249 0.3500 0.1250 0.3820 0.7389 0.4123 0.6520 0.2187 0.7468 0.5877 0.4707 0.0998 0.0637 0.6903 0.7369 0.6312 0.7299 0.6791 0.2913 0.2245 0.5252 0.7469 0.2503 0.7403 0.7411 0.6746 0.7492 0.6786 0.6901 0.5404 0.7499 0.7099 0.7479 0.7183 0.6655 0.6788 0.6770 0.4380 0.3796 0.2492 0.7500 0.6396 0.6919 0.1614 0.1661 0.1745 0.1352 0.0253 0.0420 0.3034 0.6261 0.7333 0.7101 0.6828 0.5121 0.0784 0.6180 0.6201 0.5007 0.7495 0.7447 0.7378 0.1516 0.1274 0.3242 0.2291 0.1728 0.2498
0.8354 0.8399 0.8570 0.8504 0.8559 0.8571 0.8457 0.8533 0.8393 0.8498 0.7015 0.7190 0.8571 0.6358 0.4515 0.5708 0.8204 0.7180 0.8503 0.5379 0.6998 0.8571 0.4559 0.8370 0.7581 0.8222 0.6447 0.8553 0.4796 0.6845 0.6629 0.6651 0.5503 0.2560 0.5111 0.6462 0.7997 0.7839 0.8453 0.8030 0.8016 0.3788 0.6764 0.4344 0.3729 0.8374 0.2752 0.8085 0.7947 0.3059 0.5922 0.7349 0.0851 0.7379 0.8419 0.3619 0.0900 0.8498 0.2192 0.4818 0.3247 0.7877 0.2149 0.7580 0.2174 0.2603 0.0915 0.3902 0.8566 0.8401 0.8159 0.7973 0.7400 0.8194 0.7622 0.8008 0.8552 0.7527 0.4470 0.1584 0.8547 0.8240 0.3846 0.1332 0.5320 0.8305 0.8547 0.5683 0.6083 0.7222 0.3845 0.7807 0.8073 0.5852 0.4660 0.7854 0.8567 0.4663 0.8235 0.7097 0.8405 0.5185 0.2221 0.5528 0.8498 0.5839 0.7893 0.3589 0.8550 0.7403 0.6401 0.1815 0.1198 0.8168 0.8485 0.7739 0.8439 0.8089 0.4511 0.3667 0.6887 0.8551 0.4004 0.8507 0.8513 0.8057 0.8566 0.8085 0.8166 0.7016 0.8571 0.8304 0.8558 0.8361 0.7992 0.8086 0.8074 0.6092 0.5503 0.3990 0.8571 0.7802 0.8179 0.2779 0.2849 0.2972 0.2382 0.0494 0.0807 0.4655 0.7700 0.8461 0.8305 0.8115 0.6773 0.1453 0.7639 0.7655 0.6673 0.8568 0.8537 0.8491 0.2633 0.2261 0.4896 0.3728 0.2947 0.3997
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
6 6 6 16 8 8 6 6 6 6 6 6 8 6 6 1 6 8 15 8 7 7 6 6 16 8 8 8 6 6 6 6 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
12.00000 12.00000 12.00000 31.97207 15.99491 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 1.00783 12.00000 15.99491 30.97376 15.99491 14.00307 14.00307 12.00000 12.00000 31.97207 15.99491 15.99491 15.99491 12.00000 12.00000 12.00000 12.00000 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
7869.1272 35954.0266 39812.6326
0.99999 -0.00021 0.00358 0.00020 1.00000 0.00098 -0.00358 -0.00098 0.99999
1
0.01101 0.00241 0.00218
0.22934 0.05020 0.04533
22.79 27.59 30.56 51.11 55.54 65.90 82.41 84.37 101.35 134.80 148.16 168.15 183.51 210.80 231.59 242.68 255.13 286.52 305.35 320.13 326.95 351.27 358.82 374.34 389.70 408.86 410.22 415.27 437.96 462.86 471.95 494.75 506.93 554.85 557.63 564.68 600.80 626.37 644.70 658.11 670.22 684.06 700.46 721.79 745.61 768.14 801.41 828.36 843.90 849.37 877.51 922.61 942.29 949.78 972.73 976.93 1054.32 1058.29 1100.12 1101.73 1129.53 1181.83 1190.43 1207.90 1237.06 1243.84 1271.31 1358.98 1368.44 1372.47 1400.20 1413.80 1425.72 1450.61 1485.70 1513.45 1513.87 1549.62 1563.76 1575.31 1591.55 1600.09 1619.31 1622.84 1640.39 1670.72 1694.33 1698.97 1710.11 1716.80 1738.11 1749.55 1752.68 1753.07 1765.43 1792.12 1830.14 1854.00 1858.35 1863.01 1876.85 1881.32 1909.48 1920.12 1923.36 1943.02 1952.20 1995.51 2027.88 2032.39 2044.13 2059.04 2063.43 2102.27 2112.51 2121.23 2124.28 2138.32 2154.43 2179.17 2230.14 2237.74 2259.19 2266.10 2277.15 2308.40 2334.41 2342.95 2348.58 2351.86 2356.12 2367.26 2371.46 2377.73 2385.54 2387.39 2392.50 2398.18 2419.51 2544.88 2586.40 2591.16 2610.04 4582.05 4624.09 4630.21 4632.29 4636.02 4640.51 4691.10 4697.57 4723.32 4728.24 4739.36 4741.64 4745.26 4763.77 4778.23 4818.30 4841.51 4841.95 4862.15 4878.57 4902.86 4903.56 4905.72 4917.45 5473.03
0.486382
0.516335
0.517279
0.422418
-2614.813662
-2614.783710
-2614.782766
-2614.877626
3.181620D-04
MUNgauss
RevisionA2.0
retrievium
28-Dec-2020
DUDE CC(C)S(=O)(=O)c1cc2c(cc1OC)[C@@H]3CO[P@](=O)(NN3CC2)S(=O)(=O)Oc4ccccc4 C39466035
RHF
6-31G(d)
(6D,10F)
C1
516.078998
|X|Y|Z|
58.188227 35.737372 134.547465
65.405020
22
|36.858105|
|12.467072|36.858105|
|7.497380|12.430016|36.858105|
|6.916347|10.585325|7.061395|388.023441|
|4.814673|7.238481|6.247882|94.301155|73.516695|
|6.236488|7.254812|6.000886|93.939697|13.658000|73.516695|
|5.791850|6.635786|4.524839|75.997465|12.903127|13.112429|36.858105|
|4.855090|4.887154|3.670013|49.920820|9.219450|11.973357|13.823610|36.858105|
|3.817636|3.738693|2.940885|33.604687|6.974299|8.039526|7.876924|13.688185|36.858105|
|3.506132|3.511631|2.767658|29.761496|6.544362|6.636082|6.869138|7.991128|13.767363|36.858105|
|3.811330|4.021417|3.085553|33.372075|7.563458|6.811149|7.953836|6.920977|7.896314|13.643206|36.858105|
|4.806486|5.518838|3.940240|48.505392|10.611634|8.694610|13.600227|7.922129|6.789756|7.884219|13.788082|36.858105|
|4.719133|5.950383|4.329521|45.417180|11.296702|7.787348|8.149870|5.290447|4.599749|5.200292|7.936013|14.243723|73.516695|
|3.589825|4.263907|3.443087|31.250539|8.286714|5.922126|5.247391|3.988544|3.775918|4.495756|6.692369|7.993249|24.080009|36.858105|
|2.799200|2.764109|2.275649|22.312593|5.098520|5.144476|4.437580|5.019570|7.524982|12.531402|7.605235|5.027236|6.904414|3.685198|36.858105|
|2.531022|2.566076|2.151371|20.916172|4.957046|4.790016|4.016456|4.364218|5.979594|8.932417|6.787625|4.638606|6.628861|3.689253|17.517828|0.500000|
|2.721027|2.632963|2.175334|20.008873|4.571670|4.570881|3.796915|4.020658|5.262321|7.612826|6.376070|4.444487|6.533539|3.624355|12.451346|0.245921|36.858105|
|2.289501|2.205507|1.874167|16.594356|3.844272|3.880598|2.976887|3.180760|4.006916|5.049761|4.340028|3.336207|5.133833|2.898476|7.744699|0.187602|13.292415|73.516695|
|2.020624|1.960106|1.696119|15.010319|3.515178|3.584168|2.629083|2.874497|3.614579|4.244427|3.556595|2.844027|4.399494|2.471549|6.364424|0.171829|7.064195|21.758983|332.344906|
|1.823370|1.751251|1.536391|13.213302|3.093051|3.198348|2.244531|2.447456|2.965985|3.298581|2.845763|2.378467|3.754215|2.103486|4.397718|0.117325|4.891148|13.149283|82.357127|73.516695|
|2.160025|2.107144|1.813355|16.705524|3.888725|4.041654|2.988991|3.422284|4.560056|5.170219|3.956150|3.142386|4.694948|2.563957|8.196785|0.220090|6.537669|13.381224|71.860153|12.610755|53.358707|
|2.568924|2.478991|2.082838|19.969110|4.518422|4.829690|3.762444|4.537831|6.784117|7.678562|5.061374|3.891516|5.530140|2.910077|13.022445|0.252818|7.940125|12.556856|45.378408|9.156695|17.973801|53.358707|
|2.581831|2.513777|2.131083|21.074232|4.756281|5.273470|3.916300|5.065141|7.658605|6.804169|4.570724|3.781373|5.336419|2.738196|7.823709|0.186724|5.127567|8.166929|30.638825|6.996218|11.019351|17.826211|36.858105|
|3.146068|3.004827|2.488284|25.929368|5.556267|6.689549|5.010212|7.539874|12.608165|7.573458|5.011922|4.413931|5.992355|2.919393|6.474218|0.147023|4.628698|6.924937|23.725263|5.674372|7.040844|10.787565|12.541783|36.858105|
|1.802350|1.799870|1.580944|13.850655|3.352790|3.260871|2.371990|2.497922|3.003992|3.570250|3.235700|2.625679|4.198337|2.457031|4.898493|0.158535|5.074723|11.638197|55.488462|11.413703|8.849301|6.429321|3.759724|3.013647|388.023441|
|1.936762|1.964560|1.712599|15.185854|3.717530|3.500864|2.637217|2.708697|3.240194|4.047132|3.834705|3.025734|4.862245|2.925433|5.497694|0.194572|5.677015|11.229947|40.823351|8.326556|7.589136|6.308614|3.720431|3.081109|94.727904|73.516695|
|1.662169|1.665953|1.480232|12.954554|3.156796|3.092383|2.179690|2.321082|2.759879|3.135392|2.815306|2.353750|3.772370|2.183184|4.084037|0.131787|3.905476|8.305888|40.728067|9.785630|8.065537|5.735006|3.634164|2.860821|95.392675|13.661769|73.516695|
|1.641237|1.630163|1.446591|12.268777|2.975573|2.892016|2.051029|2.126906|2.479071|2.881209|2.704918|2.264045|3.715261|2.196921|3.685582|0.111600|4.104815|9.550694|40.097235|10.572355|6.125675|4.865219|2.935542|2.475114|85.542086|13.778419|14.190845|73.516695|
|1.667281|1.651383|1.463612|12.211121|2.957883|2.853506|2.033184|2.073123|2.382469|2.794852|2.703898|2.273796|3.789338|2.271164|3.476225|0.102195|4.140311|9.488887|33.444052|8.938285|5.178379|4.423491|2.658904|2.324034|51.767988|11.493375|9.126606|24.291912|36.858105|
|1.653914|1.658531|1.475256|12.205419|2.993553|2.819849|2.016144|2.013894|2.273691|2.686326|2.698113|2.289933|3.897606|2.398343|3.219565|0.096313|3.777928|7.819905|25.937992|6.688959|4.417791|3.941478|2.427229|2.166626|40.515403|10.904846|7.634164|14.100814|13.795608|36.858105|
|1.634106|1.633760|1.458879|11.801449|2.892722|2.716487|1.925062|1.898474|2.105694|2.465564|2.530195|2.190535|3.799510|2.356561|2.848095|0.082747|3.400749|6.773226|21.439392|5.689374|3.755180|3.479708|2.167866|1.987397|29.306655|7.910186|5.850783|9.264522|8.015975|13.759450|36.858105|
|1.626071|1.602593|1.431448|11.437218|2.772088|2.650304|1.857837|1.842492|2.039336|2.357220|2.393239|2.089753|3.613216|2.200667|2.707362|0.076221|3.307562|6.729822|20.966603|5.806745|3.612816|3.379385|2.096863|1.940823|25.989197|6.641801|5.270098|8.185424|6.940009|7.921552|13.735428|36.858105|
|1.637434|1.595140|1.420031|11.438678|2.743292|2.677704|1.870589|1.887271|2.116645|2.429104|2.396222|2.076530|3.524345|2.099768|2.854697|0.079076|3.538418|7.696447|24.387795|7.103654|3.997854|3.669678|2.242085|2.051941|28.393941|6.775888|5.705415|9.303308|8.009580|6.851891|7.934631|13.753379|36.858105|
|1.657691|1.618193|1.435077|11.805150|2.828332|2.776797|1.953905|2.000993|2.288347|2.640063|2.537226|2.160382|3.601228|2.128085|3.230831|0.090667|3.973368|9.373501|31.832916|9.459053|4.834759|4.228535|2.534568|2.252409|38.222417|8.384008|7.321890|14.260385|13.805729|7.880889|6.858229|7.926661|13.742579|36.858105|
|17.561044|8.898159|6.885303|36.552836|7.116800|8.323826|4.479208|3.852820|3.215204|3.049527|3.330799|4.033622|7.369502|3.328741|2.523386|0.063813|2.518816|3.826364|11.842739|3.071484|2.706365|3.161939|2.300152|2.723817|12.081087|3.236370|2.779785|2.786786|1.606174|1.599257|1.596690|1.599355|1.604677|1.607600|0.500000|
|17.577582|8.730687|5.453153|45.511507|7.959481|10.098744|6.636984|5.680698|4.521900|4.161273|4.491102|5.569508|9.078392|3.835863|3.244421|0.079499|3.179881|4.651100|14.170216|3.605197|3.300983|4.012626|2.913699|3.610676|14.095158|3.790318|3.216761|3.189553|1.825540|1.799573|1.773006|1.769601|1.792610|1.820600|0.302154|0.500000|
|17.594968|8.799159|6.825999|45.538564|7.942560|12.371920|5.171649|4.725698|3.684562|3.252377|3.383042|4.113272|6.946172|3.066747|2.633608|0.066246|2.520734|3.833632|12.109897|3.135224|2.849537|3.382920|2.554146|3.157948|12.228324|3.247328|2.849379|2.781286|1.576716|1.553718|1.527691|1.522627|1.543213|1.570451|0.300917|0.300789|0.500000|
|8.816071|17.616681|8.851394|58.314969|12.096617|9.720986|6.419766|4.543765|3.647232|3.614206|4.378386|6.187952|13.652008|5.303144|2.854554|0.074122|2.769427|4.083687|12.582087|3.177422|2.906319|3.396756|2.475665|2.887237|13.293877|3.675101|3.046473|3.019394|1.735385|1.759872|1.743864|1.703922|1.680406|1.694596|0.211901|0.211142|0.172948|0.500000|
|6.818558|8.778556|17.583148|46.371331|9.918983|11.784237|4.191654|3.593991|2.864424|2.626050|2.834003|3.518372|6.527321|2.971259|2.175221|0.057020|2.060124|3.185760|10.251416|2.657369|2.405192|2.761741|2.106989|2.482208|10.809110|2.899314|2.549766|2.470221|1.397397|1.399476|1.378387|1.355768|1.353264|1.373238|0.169450|0.139354|0.202980|0.173218|0.500000|
|5.467340|8.760531|17.613774|47.183856|12.657704|9.600842|4.271722|3.432649|2.788562|2.661902|3.004144|3.839042|7.768302|3.556866|2.203031|0.058738|2.092730|3.215981|10.290610|2.644669|2.397201|2.727076|2.054822|2.361415|11.092599|3.022563|2.605596|2.535669|1.440714|1.461734|1.443576|1.406068|1.386718|1.402618|0.140967|0.122231|0.139708|0.213406|0.300624|0.500000|
|6.894526|8.890398|17.562773|36.979256|8.395243|8.145242|3.809434|3.174439|2.636771|2.524985|2.812337|3.478383|6.884132|3.209560|2.119104|0.055600|2.066927|3.192864|10.119520|2.626463|2.324303|2.646793|1.963733|2.262449|10.732719|2.897948|2.504865|2.479944|1.421295|1.435614|1.431595|1.412637|1.398026|1.401741|0.207874|0.140875|0.169870|0.212524|0.300981|0.300889|0.500000|
|4.801582|4.709718|3.699965|48.558721|8.795918|14.473237|9.029115|17.749690|8.895756|5.666857|4.979858|5.657200|7.617651|3.340739|4.080476|0.100732|3.367826|4.956408|16.167610|4.013640|4.187274|5.376535|4.601806|6.973388|16.006726|4.255107|3.784686|3.447178|1.882787|1.822740|1.723594|1.682056|1.728788|1.829386|0.105168|0.148211|0.139858|0.115382|0.105079|0.095062|0.088078|0.500000|
|3.316873|3.508582|2.787697|27.562302|6.555924|5.695206|5.655451|4.981324|5.638597|8.902476|17.770346|8.963843|12.718125|7.475200|7.112219|0.192681|6.827393|8.233535|22.991293|5.179831|5.274282|6.311791|4.003345|4.094396|24.943285|7.766083|5.269500|5.245397|3.006319|3.070979|2.882738|2.678460|2.633595|2.774036|0.083407|0.106084|0.081657|0.108750|0.070672|0.076324|0.072005|0.108058|0.500000|
|3.440383|4.205067|3.563254|29.349046|8.144428|5.595458|4.428940|3.424952|3.179706|3.611102|4.895544|5.898279|16.994867|17.667257|3.049706|0.085002|3.022151|4.452078|13.581635|3.350470|3.048237|3.404478|2.385175|2.544023|15.482093|4.533698|3.483396|3.520968|2.053604|2.180867|2.169892|2.034518|1.928707|1.935352|0.090753|0.098300|0.081749|0.148368|0.083905|0.105225|0.093633|0.082630|0.146078|0.500000|
|3.126329|3.662043|3.049470|28.682972|7.860019|5.604754|4.898009|3.895744|3.801059|4.610914|6.721085|7.185216|16.450907|17.591923|3.865816|0.112439|3.666586|5.255766|16.041002|3.838666|3.665043|4.102564|2.854159|2.966911|18.726546|5.703850|4.178595|4.119970|2.365429|2.515106|2.425608|2.222243|2.116260|2.173542|0.079920|0.092509|0.076517|0.119301|0.075006|0.088481|0.078223|0.090681|0.217561|0.299818|0.500000|
|3.439793|3.845808|3.112586|26.952641|6.774382|5.323256|4.626323|3.707084|3.655466|4.500676|6.630084|6.856461|16.418367|17.574979|3.843718|0.105419|4.023882|5.658733|16.443128|3.971113|3.609908|4.074176|2.725322|2.865466|18.486534|5.541609|4.020534|4.182013|2.481478|2.640258|2.632100|2.465724|2.332355|2.336836|0.090564|0.104690|0.081387|0.131117|0.075407|0.087042|0.082677|0.086403|0.228995|0.299959|0.298318|0.500000|
|2.993452|2.803169|2.287462|20.770654|4.619696|4.774836|3.939826|4.198756|5.376560|7.153839|6.063029|4.488338|6.582094|3.527913|8.838680|0.174061|17.663975|16.823260|35.669551|7.878463|7.344399|9.449897|4.797860|4.705626|28.720525|7.671167|5.813274|6.173981|3.573657|3.276102|3.069453|3.091119|3.331395|3.605030|0.077161|0.099654|0.076690|0.081473|0.060219|0.060222|0.060717|0.098155|0.168398|0.082591|0.095466|0.109414|0.500000|
|2.681094|2.649203|2.193652|19.854929|4.631847|4.428852|3.714246|3.714662|4.560835|6.619007|6.660726|4.599650|7.050755|4.128341|8.751114|0.217994|17.688572|16.789414|35.595645|7.424520|6.945421|7.754150|4.165392|3.868178|35.106826|10.845789|6.634512|7.355150|4.375484|4.226650|3.854001|3.646678|3.734903|4.072454|0.069633|0.086087|0.067970|0.079162|0.056999|0.059136|0.058172|0.086298|0.230952|0.094060|0.116527|0.132899|0.299092|0.500000|
|2.023559|1.966359|1.712041|15.595368|3.633026|3.842064|2.720696|3.145292|4.067053|4.297144|3.367356|2.785978|4.211720|2.285839|5.937501|0.160431|4.941541|10.038066|52.992331|12.095704|25.905573|12.725679|7.734655|4.908729|38.747876|8.048946|9.879790|7.178363|3.383182|2.887371|2.480671|2.408708|2.677397|3.216010|0.051845|0.062522|0.055130|0.054821|0.046732|0.046170|0.044813|0.080830|0.090511|0.056244|0.066425|0.065081|0.121472|0.112136|0.500000|
|2.337877|2.253616|1.946168|18.536061|4.204785|4.735286|3.274920|4.123426|5.561650|4.952314|3.642839|3.132455|4.576299|2.371202|5.687229|0.141929|4.274136|7.337816|29.253102|7.141907|10.240357|12.552314|17.579447|8.881102|25.126288|5.937715|6.296577|5.018828|2.530130|2.280352|2.039608|1.991081|2.152315|2.443416|0.058506|0.072418|0.065061|0.061263|0.053918|0.052058|0.050164|0.109621|0.091165|0.058379|0.068226|0.065795|0.113708|0.098078|0.240254|0.500000|
|2.446041|2.448459|2.096568|20.954613|4.872381|5.190051|3.847341|4.804050|6.777579|6.363481|4.525127|3.765325|5.365108|2.789458|7.118043|0.198886|4.609981|7.364335|28.087993|6.377052|9.806403|12.272621|17.483604|8.785045|27.300695|6.921048|6.807098|5.217827|2.623045|2.431033|2.150729|2.045356|2.157538|2.441871|0.060577|0.075375|0.067001|0.067333|0.057451|0.056929|0.053383|0.120954|0.111640|0.067524|0.082786|0.075907|0.115205|0.109761|0.190574|0.300758|0.500000|
|3.034580|2.940708|2.487631|26.141226|5.647241|7.077762|4.730483|7.093773|8.905181|5.721657|4.244074|3.984516|5.567720|2.704261|4.897760|0.120545|3.694012|5.713593|20.043914|4.936725|5.785598|7.747757|8.899180|17.566472|19.004234|4.847436|4.629197|3.954144|2.082785|1.958667|1.803228|1.756314|1.844755|2.013201|0.072677|0.093781|0.086662|0.077061|0.070085|0.065909|0.062244|0.209836|0.097900|0.066596|0.076713|0.072414|0.103361|0.089396|0.116703|0.210820|0.215392|0.500000|
|3.195126|2.929095|2.432869|24.114388|5.081794|6.327924|4.463861|6.353380|8.865364|6.163258|4.384861|3.944490|5.516088|2.695462|5.582183|0.124313|4.461013|6.858790|23.226090|5.755210|6.534351|9.655203|8.921398|17.544410|20.164741|5.050903|4.752695|4.247853|2.267946|2.095485|1.942072|1.926676|2.058092|2.245316|0.077525|0.103194|0.090139|0.077637|0.067813|0.063219|0.062192|0.172435|0.102161|0.065975|0.074578|0.074691|0.133607|0.102196|0.129390|0.219754|0.173594|0.302574|0.500000|
|1.634784|1.658161|1.479200|12.329266|3.057145|2.839574|2.032989|2.022461|2.276335|2.693869|2.726733|2.317451|3.958323|2.461095|3.203750|0.098985|3.592798|7.131353|24.318828|6.113749|4.355640|3.879744|2.430691|2.159561|41.402578|12.143482|8.068648|12.894729|8.945588|17.764164|8.861593|5.626921|4.944917|5.635153|0.043726|0.049161|0.042689|0.048918|0.038957|0.040973|0.039816|0.050796|0.086667|0.062198|0.073063|0.074350|0.085497|0.112254|0.079172|0.063089|0.068932|0.054622|0.057261|0.500000|
|1.600499|1.614499|1.450015|11.613371|2.873635|2.658431|1.874444|1.826136|1.997760|2.329629|2.438501|2.142688|3.781356|2.383884|2.621757|0.076594|3.057450|5.824978|18.475619|4.870877|3.370667|3.175866|2.014269|1.868207|25.188326|7.020702|5.205047|7.482090|5.683201|8.943754|17.723158|8.905842|5.643689|4.944794|0.043589|0.047905|0.041445|0.048129|0.037918|0.040064|0.039615|0.046107|0.077574|0.061661|0.068289|0.073981|0.077333|0.097242|0.062194|0.052480|0.055946|0.047449|0.050495|0.213812|0.500000|
|1.587353|1.562361|1.403329|11.017625|2.673134|2.551191|1.768154|1.740193|1.899962|2.173404|2.231696|1.982980|3.472615|2.118548|2.433805|0.067922|2.939538|5.776260|17.942734|5.002391|3.191999|3.043144|1.915663|1.800881|21.626103|5.575753|4.518213|6.497548|4.986989|5.640974|8.912727|17.721117|8.917134|5.641773|0.043720|0.047757|0.041218|0.046251|0.036857|0.038277|0.038709|0.044321|0.069011|0.055039|0.058800|0.066088|0.078144|0.089862|0.059630|0.050610|0.051841|0.045527|0.049877|0.123783|0.214814|0.500000|
|1.606235|1.550103|1.384327|11.020031|2.627712|2.595136|1.787864|1.808838|2.014870|2.276185|2.236075|1.963028|3.335500|1.965134|2.631644|0.071611|3.241094|6.946840|22.087596|6.674216|3.697679|3.444222|2.123609|1.966660|24.181817|5.719175|5.027399|7.521145|5.681120|4.941736|5.642314|8.908608|17.726220|8.937324|0.043969|0.048811|0.042171|0.045181|0.036741|0.037389|0.038023|0.046344|0.067267|0.050450|0.054462|0.060459|0.087632|0.092954|0.069770|0.057121|0.056236|0.049238|0.055456|0.107400|0.124052|0.214752|0.500000|
|1.640752|1.588760|1.409796|11.628458|2.766759|2.763188|1.924289|1.999350|2.302110|2.612980|2.453049|2.095491|3.456403|2.008790|3.223059|0.088946|3.901572|9.566561|35.101484|11.876707|5.142537|4.403020|2.630857|2.315944|37.411177|7.669793|7.463188|13.133214|8.958221|5.636398|4.946716|5.625254|8.842750|17.743079|0.044103|0.050135|0.043478|0.045838|0.037687|0.038131|0.038202|0.051118|0.072982|0.050768|0.056833|0.060690|0.100041|0.105833|0.096934|0.071679|0.069508|0.057408|0.064812|0.124497|0.107426|0.123698|0.213330|0.500000|
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