Version2.4
2021-04-30T09:56:50Z
10.1021/jm300687e
Gaussian16
RevisionB.01
SBUNGAY
11-Jan-2019
#N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2)
DUDE Cc1c(scn1)CCO[C@@H](C[NH3+])c2cccc(c2)Br C43023165
RHF
6-31G(d)
(6D,7F)
Cc1c(scn1)CCO[C@@H](C[NH3+])c2cccc(c2)Br
C01[X(C14H18Br1N2O1S1)]
105
C1
340
[NH3+]C[C@@H](c1cccc(c1)Br)OCCc1scnc1C
[NH3+]C[C@@H](c1cccc(c1)Br)OCCc1scnc1C
Cc1ncsc1CCO[C@@H](C[NH3+])c2cccc(Br)c2
InChIKey=MAHMTODXMJETTO-ZDUSSCGKSA-O
InChI=1S/C14H17BrN2OS/c1-10-14(19-9-17-10)5-6-18-13(8-16)11-3-2-4-12(15)7-11/h2-4,7,9,13H,5-6,8,16H2,1H3/p+1/t13-/m0/s1
InChI=1/C14H17BrN2OS/c1-10-14(19-9-17-10)5-6-18-13(8-16)11-3-2-4-12(15)7-11/h2-4,7,9,13H,5-6,8,16H2,1H3/p+1/t13-/m0/s1/fC14H18BrN2OS/h16H/q+1
Cc1c(scn1)CCO[C@@H](C[NH3+])c2cccc(c2)Br
C01[X(C14H18Br1N2O1S1)]
105
C01
340
[NH3+]C[C@@H](c1cccc(c1)Br)OCCc1scnc1C
[NH3]C[C@@H]([C]1[CH][CH][CH][C]([CH]1)Br)OCCC1=[C]([N]=[CH]S1)C
Cc1ncsc1CCO[C@@H](C[NH3])[C]2[CH][CH][CH][C](Br)[CH]2
InChIKey=OKUXLPHOBIWDFB-ZDUSSCGKSA-N
InChI=1S/C14H18BrN2OS/c1-10-14(19-9-17-10)5-6-18-13(8-16)11-3-2-4-12(15)7-11/h2-4,7,9,13H,5-6,8H2,1,16H3/t13-/m0/s1
InChI=1/C14H18BrN2OS/c1-10-14(19-9-17-10)5-6-18-13(8-16)11-3-2-4-12(15)7-11/h2-4,7,9,13H,5-6,8H2,1,16H3/t13-/m0/s1
1887.8199354050
-3691.5694105
1-A
9551.9806
87
253
340
|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|
-490.15773 -92.05545 -64.56919 -58.70873 -58.70677 -58.70667 -20.72531 -15.88063 -15.64422 -11.46807 -11.45913 -11.40542 -11.40414 -11.38269 -11.37423 -11.36262 -11.36045 -11.35457 -11.35310 -11.35300 -11.35089 -11.34928 -11.30128 -9.81758 -9.06707 -7.56700 -7.55782 -7.55780 -6.74958 -6.74860 -6.74693 -3.30604 -3.30159 -3.30155 -3.29088 -3.29088 -1.55214 -1.49922 -1.36822 -1.29584 -1.23117 -1.19092 -1.17121 -1.14311 -1.12448 -1.11168 -1.07490 -1.03654 -1.01030 -0.98565 -0.96718 -0.95662 -0.94107 -0.91846 -0.87614 -0.85064 -0.83670 -0.82225 -0.81204 -0.78994 -0.76980 -0.75731 -0.75484 -0.74547 -0.72735 -0.70909 -0.68728 -0.68193 -0.67312 -0.66625 -0.65030 -0.64105 -0.63289 -0.62817 -0.61861 -0.61607 -0.60638 -0.59645 -0.57555 -0.56249 -0.53409 -0.50389 -0.49848 -0.46189 -0.46000 -0.43615 -0.41268
|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|
-0.00681 0.00990 0.01679 0.04643 0.06298 0.07405 0.07714 0.08921 0.10313 0.11942 0.12994 0.14200 0.14918 0.15859 0.16738 0.17835 0.18955 0.19060 0.20012 0.20803 0.21116 0.21561 0.22458 0.22874 0.23976 0.25189 0.25309 0.26834 0.27327 0.28785 0.29658 0.30148 0.32139 0.34153 0.35081 0.35753 0.37181 0.38051 0.39208 0.40093 0.40833 0.43091 0.46860 0.49149 0.50016 0.53863 0.53989 0.55325 0.56009 0.56414 0.57013 0.57584 0.57831 0.59396 0.60018 0.60388 0.61675 0.62331 0.62403 0.64861 0.65740 0.66009 0.66580 0.67138 0.68030 0.69397 0.70983 0.71514 0.71729 0.73074 0.73665 0.74305 0.75431 0.76627 0.77706 0.78817 0.80514 0.81113 0.82925 0.84021 0.84299 0.85177 0.86577 0.87739 0.87940 0.89005 0.91588 0.91805 0.92503 0.92567 0.93167 0.93753 0.93995 0.94885 0.95842 0.97002 0.97357 0.99051 0.99517 1.00268 1.00861 1.01285 1.02543 1.03316 1.03675 1.04437 1.04662 1.05385 1.06398 1.06748 1.08501 1.09659 1.10820 1.11551 1.12262 1.13152 1.13974 1.15880 1.16273 1.16753 1.18322 1.19117 1.20328 1.22793 1.23737 1.25645 1.27468 1.28671 1.30090 1.34353 1.35603 1.36080 1.37921 1.39047 1.42951 1.44801 1.46049 1.49153 1.52110 1.54491 1.57284 1.57817 1.59515 1.60078 1.60933 1.62335 1.63986 1.64189 1.65028 1.66566 1.69026 1.72141 1.72683 1.73377 1.75292 1.77341 1.78552 1.79953 1.81689 1.86903 1.91791 1.93884 1.95273 1.96446 2.00059 2.01025 2.02066 2.03897 2.05886 2.07547 2.08457 2.09882 2.11045 2.12756 2.13859 2.15911 2.17192 2.17344 2.20020 2.20891 2.22071 2.23761 2.27590 2.28407 2.29449 2.31792 2.33576 2.34426 2.35252 2.36040 2.37843 2.40872 2.42560 2.46492 2.46728 2.47876 2.48412 2.49506 2.51423 2.52110 2.52835 2.53319 2.56011 2.57343 2.60920 2.63952 2.66250 2.67722 2.69778 2.70803 2.71570 2.76046 2.78239 2.80522 2.83601 2.85925 2.86191 2.88075 2.89394 2.93214 2.94253 2.96158 3.00611 3.02312 3.04802 3.09488 3.14153 3.19878 3.27176 3.34062 3.34823 3.42893 3.67422 4.00405 4.27900 4.34161 4.37315 4.39787 4.41767 4.44093 4.47270 4.53057 4.54961 4.55702 4.63335 4.68548 4.69699 4.78064 4.84482 4.91363 5.02134 9.18708 74.40663
11.04420
-2.1453 17.3757 -2.7833
17.7275
|XX|YY|ZZ|XY|XZ|YZ|
-115.1758 -59.2622 -112.3933 -3.0316 -3.6810 -18.5358
|XX|YY|ZZ|XY|XZ|YZ|
-19.5654 36.3482 -16.7828 -3.0316 -3.6810 -18.5358
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ|
-54.2015 299.6818 -35.2297 -83.5504 3.8204 45.5302 -63.6592 37.4521 -114.9713 10.1472
|XXXX|YYYY|ZZZZ|XXXY|XXXZ|YYYX|YYYZ|ZZZX|ZZZY|XXYY|XXZZ|YYZZ|XXYZ|YYXZ|ZZXY|
-7334.6150 -1408.5362 -832.8840 284.0148 221.3310 204.8115 -387.7901 24.4946 -59.8679 -1872.8241 -1356.7599 -418.4945 -23.0197 45.5505 48.8440
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341.03232
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
|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|
12.1962 15.2464 28.4762 47.5878 66.7582 92.7272 99.0159 123.6058 138.4768 163.3880 185.6106 188.7623 204.4556 243.8405 268.6419 298.4715 322.5879 331.8673 341.1088 362.1407 364.2928 414.5066 481.3958 509.3560 562.8148 576.1094 611.2726 643.3345 687.5462 711.6304 732.2444 739.4984 772.4053 778.4573 847.9956 893.1795 902.2612 917.1652 959.2081 964.6205 973.6381 997.0722 1039.6300 1048.9843 1055.9823 1086.0898 1087.8443 1096.3173 1136.5912 1146.9083 1171.8158 1182.4063 1194.0769 1204.1718 1223.8954 1229.5750 1261.4809 1271.4238 1274.3298 1322.9723 1333.6458 1359.5240 1381.7624 1442.9917 1445.9758 1453.6071 1461.0038 1475.6823 1481.0405 1516.3700 1556.6040 1571.9157 1583.2599 1598.5761 1621.2747 1626.1357 1630.5181 1645.0505 1649.3581 1658.6224 1674.4916 1680.1475 1777.7566 1791.0793 1796.7187 1814.8100 1837.8715 3187.3940 3219.1669 3222.3037 3223.4571 3276.6074 3283.6151 3300.2690 3300.5024 3306.3098 3362.1289 3370.1592 3393.7691 3396.4617 3414.7648 3428.7910 3611.0786 3712.0204 3744.6865
5.2772 9.4412 5.0452 4.5734 4.0906 3.5150 3.4368 1.0786 2.8590 2.4338 4.8907 4.9238 4.2757 1.2159 3.2772 3.4735 4.6693 3.9036 4.5047 3.7075 4.8087 3.3525 3.5752 3.9000 3.8206 5.3795 4.7423 5.0752 5.5090 4.5943 6.0873 7.1292 3.4456 2.3984 1.4488 1.8133 1.4831 3.3992 3.3628 1.2484 2.0183 2.8526 1.6146 1.6296 1.3910 5.3783 1.8727 2.2369 1.3681 2.9180 1.6168 2.3393 2.2044 1.8008 2.9704 2.1983 2.9846 2.6662 2.2838 1.4076 2.3687 1.2647 1.6627 1.1552 1.2400 1.3264 1.3185 1.7326 1.6045 1.4573 1.4721 1.3379 1.5613 1.9432 1.0454 1.0953 1.0925 1.0932 2.2038 1.1699 1.1347 6.0052 5.2573 7.8703 5.4146 1.0474 1.0451 1.0856 1.0620 1.0488 1.0610 1.0960 1.1026 1.0618 1.1008 1.1033 1.0912 1.1144 1.0933 1.0927 1.0966 1.0963 1.0367 1.0900 1.0955
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0.9479 1.3893 1.5995 0.0475 7.3783 7.5482 7.0013 0.2073 12.8191 0.7252 3.1267 2.6832 1.8297 2.0628 1.3855 3.5634 1.9649 2.3012 26.1270 6.4434 17.7484 2.4968 7.5313 8.9898 3.8409 1.5288 2.0627 1.6209 5.1939 12.3476 25.3725 5.6283 10.1789 13.4085 1.4299 45.4619 25.5292 15.6817 23.3394 13.2726 9.4017 23.4513 12.7969 10.3811 3.8159 7.5790 0.8362 10.1467 0.2429 2.2666 2.9312 21.3587 262.5254 4.5197 1.9676 15.5012 123.4479 44.5518 21.5567 8.2237 50.9155 0.9319 1.0733 2.0578 16.7382 0.1195 12.9759 44.8181 10.6939 47.0385 3.9650 5.2145 11.8148 22.7088 4.3951 6.3600 7.4500 9.0896 23.9716 190.2810 18.5839 63.4725 25.2627 34.3274 7.6983 52.5690 58.4210 24.7182 30.6731 33.5812 6.0629 4.4747 12.4896 3.8062 29.4501 32.6046 7.0197 1.3035 5.7708 0.5773 1.2797 0.6557 77.4036 199.0840 118.9098
1.9645 1.4005 5.6463 1.1818 0.9385 0.7739 1.1566 0.2128 0.5624 0.4393 1.4209 1.6765 2.5238 1.3268 2.6557 1.6110 3.9546 1.9638 2.7900 1.7389 1.8390 0.5750 0.4517 0.8072 3.0610 2.1328 6.4112 1.5383 3.1961 4.2431 5.0574 4.8094 3.9932 0.5475 2.1937 9.1511 1.5672 3.3169 5.2624 0.9710 10.7274 3.0041 2.4203 3.7888 1.4052 30.6753 5.5799 11.1901 0.1569 10.0667 2.8886 4.0570 1.5120 1.7289 4.2620 1.4323 6.4925 2.3312 3.2074 1.0538 12.6104 0.8511 2.9619 14.4362 8.9703 2.2796 5.8960 10.7418 6.4535 4.7648 2.0524 10.2073 4.0018 0.8422 15.2307 18.3100 7.7700 20.9422 0.9429 2.7810 4.5972 54.1792 11.0207 16.9372 23.6546 9.0168 5.3716 36.1961 22.6741 96.6087 157.6310 32.4206 95.8674 58.6328 55.9313 19.6643 58.1538 39.1600 86.1304 51.5446 127.8441 142.6775 69.3163 35.0608 55.8774
0.7487 0.7429 0.7418 0.7473 0.6980 0.6315 0.7396 0.6281 0.7428 0.6694 0.7483 0.5631 0.6900 0.4485 0.5888 0.2175 0.1116 0.6333 0.2398 0.7486 0.5763 0.6885 0.7489 0.6284 0.1638 0.5392 0.2383 0.0813 0.6874 0.6868 0.1359 0.6749 0.0973 0.6786 0.4456 0.2077 0.7458 0.2477 0.4218 0.7319 0.3624 0.7492 0.6881 0.6029 0.6571 0.0943 0.3520 0.4690 0.5684 0.2178 0.5213 0.1884 0.7500 0.5368 0.4443 0.5671 0.7055 0.4126 0.7498 0.1643 0.2061 0.0554 0.6671 0.6828 0.6970 0.6974 0.5373 0.2608 0.5232 0.7065 0.7078 0.7488 0.3016 0.5414 0.7492 0.6138 0.7430 0.6662 0.3582 0.3292 0.7496 0.2568 0.7016 0.2632 0.6797 0.6923 0.7416 0.2377 0.6431 0.1155 0.0267 0.6441 0.7244 0.1350 0.5693 0.4408 0.4562 0.6649 0.3888 0.2798 0.1870 0.3176 0.0365 0.4243 0.6639
0.8563 0.8525 0.8518 0.8553 0.8221 0.7742 0.8503 0.7716 0.8524 0.8020 0.8561 0.7205 0.8166 0.6192 0.7412 0.3573 0.2009 0.7755 0.3869 0.8562 0.7312 0.8155 0.8564 0.7718 0.2815 0.7006 0.3849 0.1504 0.8147 0.8143 0.2393 0.8059 0.1773 0.8085 0.6165 0.3440 0.8544 0.3971 0.5933 0.8452 0.5320 0.8566 0.8152 0.7523 0.7931 0.1724 0.5207 0.6385 0.7248 0.3576 0.6853 0.3171 0.8571 0.6986 0.6153 0.7237 0.8273 0.5842 0.8570 0.2822 0.3418 0.1050 0.8003 0.8115 0.8214 0.8217 0.6990 0.4137 0.6870 0.8280 0.8289 0.8564 0.4634 0.7025 0.8566 0.7607 0.8525 0.7997 0.5274 0.4954 0.8569 0.4086 0.8246 0.4167 0.8093 0.8182 0.8516 0.3842 0.7828 0.2071 0.0521 0.7835 0.8402 0.2380 0.7255 0.6119 0.6266 0.7987 0.5599 0.4373 0.3151 0.4821 0.0705 0.5958 0.7980
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
6 6 6 16 6 7 6 6 8 6 1 6 7 1 1 1 6 6 6 6 6 6 35 1 1 1 1 1 1 1 1 1 1 1 1 1 1
12.00000 12.00000 12.00000 31.97207 12.00000 14.00307 12.00000 12.00000 15.99491 12.00000 1.00783 12.00000 14.00307 1.00783 1.00783 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 78.91834 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
5515.7985 13805.2721 17008.2460
0.99897 -0.04358 -0.01298 0.04321 0.99870 -0.02714 0.01414 0.02655 0.99955
1
0.01570 0.00627 0.00509
0.32719 0.13073 0.10611
17.55 21.94 40.97 68.47 96.05 133.41 142.46 177.84 199.24 235.08 267.05 271.59 294.17 350.83 386.52 429.43 464.13 477.48 490.78 521.04 524.14 596.38 692.62 732.85 809.77 828.89 879.48 925.61 989.23 1023.88 1053.54 1063.97 1111.32 1120.03 1220.08 1285.09 1298.15 1319.60 1380.09 1387.87 1400.85 1434.56 1495.80 1509.25 1519.32 1562.64 1565.17 1577.36 1635.30 1650.15 1685.98 1701.22 1718.01 1732.53 1760.91 1769.08 1814.99 1829.30 1833.48 1903.46 1918.82 1956.05 1988.05 2076.14 2080.44 2091.42 2102.06 2123.18 2130.89 2181.72 2239.61 2261.64 2277.96 2299.99 2332.65 2339.65 2345.95 2366.86 2373.06 2386.39 2409.22 2417.36 2557.80 2576.96 2585.08 2611.11 2644.29 4585.95 4631.66 4636.18 4637.84 4714.31 4724.39 4748.35 4748.69 4757.04 4837.35 4848.91 4882.88 4886.75 4913.08 4933.27 5195.54 5340.77 5387.77
0.328577
0.347001
0.347945
0.276941
-3691.240833
-3691.222409
-3691.221465
-3691.292470
2.381519D-04
MUNgauss
RevisionA2.1
retrievium
30-Apr-2021
DUDE Cc1c(scn1)CCO[C@@H](C[NH3+])c2cccc(c2)Br C43023165
RHF
6-31G(d)
(6D,10F)
C1
341.032321
|X|Y|Z|
80.071160 49.014535 27.173678
47.422358
15
|36.858105|
|12.697057|36.858105|
|7.438378|14.131422|36.858105|
|4.746446|7.523646|10.925886|388.023441|
|5.336689|8.676236|7.858435|78.492080|36.858105|
|7.752156|13.768681|8.260597|53.260112|14.991581|53.358707|
|5.897675|7.380016|12.664333|47.851522|4.881365|6.881980|36.858105|
|4.794982|5.513945|7.595944|38.155418|4.090884|5.679374|12.510163|36.858105|
|3.795972|4.050557|5.103425|28.450268|3.175983|4.395143|7.986296|13.370927|73.516695|
|3.154751|3.288448|3.889421|23.337225|2.716346|3.741294|5.161791|7.942172|24.241829|36.858105|
|2.949007|3.170406|3.777298|23.969864|2.753002|3.704951|4.734885|7.268669|16.594509|17.489201|0.500000|
|2.645010|2.719482|3.156288|19.575554|2.308215|3.162537|4.086872|5.213594|14.647871|12.456969|0.246254|36.858105|
|2.533064|2.680813|3.195107|20.498611|2.345729|3.147443|4.166883|4.904758|12.968890|7.729619|0.191408|12.622489|53.358707|
|2.825719|3.028058|3.713927|23.297503|2.601674|3.490049|5.123135|5.795879|16.031009|7.524443|0.180410|9.267241|25.568714|0.500000|
|2.304015|2.408331|2.812707|18.219044|2.125106|2.858945|3.564579|3.968405|9.713037|5.671518|0.142018|9.011609|25.673092|0.320691|0.500000|
|2.399499|2.587613|3.098053|20.695912|2.343531|3.092174|3.899264|4.634307|11.106536|6.856089|0.198154|9.032354|25.667189|0.323985|0.324439|0.500000|
|3.187068|3.155673|3.504216|20.683653|2.547514|3.608297|4.335761|6.205434|13.794185|12.560860|0.247724|7.648560|6.816304|0.134980|0.115943|0.126100|36.858105|
|2.800483|2.790551|3.023166|18.690376|2.355804|3.308848|3.491665|4.747992|9.299405|7.560913|0.203473|5.575674|5.464243|0.105437|0.096060|0.107379|13.744348|36.858105|
|2.643382|2.554507|2.664987|16.508344|2.156076|3.072878|2.970329|3.766296|7.063053|5.020301|0.132953|4.154635|4.320779|0.084458|0.079049|0.084545|7.931781|13.738772|36.858105|
|2.776878|2.581118|2.632612|15.906976|2.113235|3.072590|2.936441|3.572625|6.700635|4.434498|0.110920|3.810840|4.021809|0.080132|0.074918|0.076790|6.853320|7.927554|13.772445|36.858105|
|3.157914|2.866816|2.937737|17.109178|2.251536|3.312773|3.394733|4.095758|7.937051|5.035088|0.117020|4.320105|4.484937|0.091173|0.083365|0.082946|7.955273|6.899536|7.974572|13.746986|36.858105|
|3.435376|3.210481|3.436157|19.550581|2.479396|3.611077|4.240590|5.449467|11.594881|7.573402|0.156256|5.982933|5.799918|0.119315|0.104047|0.103981|13.700686|7.929725|6.872651|7.913496|13.797225|36.858105|
|3.079229|2.664469|2.634118|15.312091|2.073239|3.104201|2.962538|3.260861|6.150077|3.566517|0.085199|3.288974|3.679601|0.076183|0.070791|0.067921|4.603791|4.095595|4.606133|6.697861|10.077735|6.719416|2539.412838|
|17.573288|8.948478|5.854524|29.741013|4.884203|9.497229|4.787668|3.867608|5.738897|2.723976|0.070946|2.360024|3.118687|0.070726|0.058790|0.060327|2.737146|2.431855|2.322091|2.452640|2.770643|2.962821|95.307235|0.500000|
|17.567373|8.943119|5.863832|29.731762|4.872940|9.455156|4.813191|4.355259|6.191002|3.021644|0.079344|2.515117|3.218660|0.071883|0.059775|0.062673|3.163042|2.859224|2.761418|2.916731|3.247300|3.408080|107.680911|0.302806|0.500000|
|17.599893|8.819015|6.938684|30.619354|4.375085|7.666061|6.649674|5.393157|7.797502|3.553669|0.089259|2.969232|3.812507|0.087517|0.070595|0.072288|3.622265|3.068869|2.878876|3.082617|3.652114|4.065389|122.229991|0.300936|0.301029|0.500000|
|4.225483|5.911896|5.477669|55.124505|17.760134|12.541265|3.861520|3.382621|4.853262|2.397363|0.068140|2.071448|2.875075|0.064247|0.053632|0.059108|2.261186|2.128166|1.965936|1.919484|2.017955|2.192466|63.609053|0.111830|0.111527|0.098656|0.500000|
|4.593875|5.666741|8.917475|46.244124|4.439866|5.902739|17.542135|8.899581|13.091341|4.849399|0.126032|4.111120|6.182006|0.162772|0.108394|0.118911|3.869696|3.161166|2.680706|2.624814|2.995282|3.712731|89.933480|0.111229|0.106695|0.139208|0.100962|0.500000|
|6.531285|6.874963|8.934209|36.573427|4.225758|6.317062|17.592978|8.919606|12.910703|4.837222|0.117136|3.998183|5.400528|0.134360|0.096872|0.099661|4.294680|3.388821|2.955837|3.026967|3.628242|4.533953|112.013344|0.148954|0.141729|0.233809|0.094999|0.304093|0.500000|
|5.340793|5.709416|6.846243|33.845038|4.000939|5.825204|8.833614|17.617552|16.460980|7.178328|0.180059|4.691280|5.613187|0.127941|0.095695|0.108027|6.939799|5.363233|4.345108|4.180612|4.828285|6.340444|126.403038|0.114913|0.141712|0.169442|0.092214|0.173941|0.214168|0.500000|
|4.128040|4.995740|6.906132|41.688511|4.228995|5.545034|8.794688|17.545012|16.497150|7.136946|0.218006|4.820358|6.428423|0.149503|0.105615|0.132710|5.446702|4.573956|3.588203|3.269918|3.557059|4.496538|96.478170|0.094838|0.107158|0.121061|0.098658|0.210448|0.173669|0.301065|0.500000|
|2.667608|2.667801|3.035575|18.403409|2.213215|3.079514|3.938615|4.736724|12.862888|8.810329|0.173572|17.656059|12.425398|0.218493|0.225689|0.179773|7.055661|5.021744|4.011507|3.912619|4.682664|6.572892|125.175138|0.066667|0.070144|0.084708|0.055110|0.108944|0.112708|0.122237|0.116097|0.500000|
|2.343491|2.404064|2.736577|17.467922|2.094463|2.856490|3.374880|4.220794|10.346919|8.711362|0.214788|17.654115|12.263662|0.180693|0.211449|0.221267|6.721960|5.666658|4.255300|3.765643|4.038156|5.171296|104.392647|0.058565|0.062835|0.071888|0.052892|0.094033|0.091235|0.109475|0.113457|0.299552|0.500000|
|2.588303|2.651781|2.909036|18.669343|2.327384|3.204364|3.304623|4.480975|8.597821|6.990607|0.223602|5.307554|5.462387|0.103522|0.095392|0.112436|8.892898|17.702996|8.928828|5.647050|4.964777|5.634457|113.182719|0.062846|0.073177|0.077167|0.058935|0.084874|0.086623|0.134101|0.128144|0.125427|0.157558|0.500000|
|2.377285|2.317183|2.398738|15.250610|2.013695|2.848413|2.608068|3.225951|5.920398|4.092784|0.113669|3.513379|3.807275|0.074102|0.070509|0.076000|5.645003|8.915871|17.735703|8.943667|5.665288|4.953267|130.320679|0.058643|0.069491|0.070508|0.051624|0.066159|0.071422|0.101322|0.087875|0.093262|0.102380|0.215627|0.500000|
|2.557346|2.353921|2.358474|14.436898|1.953288|2.848999|2.569545|3.016770|5.553361|3.548426|0.090847|3.158585|3.460137|0.069111|0.065516|0.066582|4.944942|5.638919|8.904561|17.757765|8.918566|5.642325|219.873319|0.063727|0.075457|0.077760|0.049738|0.064297|0.073830|0.096651|0.077653|0.090532|0.087561|0.124151|0.214984|0.500000|
|3.700389|3.405282|3.673143|20.287591|2.553730|3.746237|4.738134|5.700820|12.708243|7.003759|0.141509|5.971835|6.100633|0.130914|0.110710|0.105709|8.874014|5.636810|4.954130|5.643670|8.949873|17.744311|221.325173|0.089171|0.098528|0.126522|0.062218|0.115202|0.149737|0.174776|0.124314|0.197715|0.135074|0.123770|0.107569|0.124341|0.500000|
3690.267480
-12542.607237
3485.864379
-215.128673
-5581.604051
1887.820071
-3693.783980
2.000953
403800000000000A
42EAB44B22B85FF8
42738842A8C15F10
4129926000000000
BCEEFFFFFFFFFFFF
4272EBE58C255FFF