71461962 -OEChem-05102405592D 183187 0 1 0 0 0 0 0999 V2000 9.8280 7.1760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5819 5.6068 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5209 3.9925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5315 -2.7062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1994 -3.4505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8386 0.4772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6104 0.9347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5998 7.6335 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5925 -1.0919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5244 1.7596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8922 -6.6339 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8171 0.6835 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.1779 -3.2443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0282 -12.3370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5389 6.0192 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8746 4.5306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2247 7.3016 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.9102 -4.6072 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.8852 -2.1681 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.9532 -6.6291 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8996 2.0915 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.5495 -0.6795 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2353 0.6029 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.2459 -6.0958 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1567 10.1532 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8890 8.7902 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.6245 -7.9969 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7995 11.8480 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.4635 0.1454 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.8242 -3.7824 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4458 11.3099 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1852 5.4811 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1637 5.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4744 6.6379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8710 6.7635 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5174 6.2254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1817 7.7140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4529 6.8441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8066 7.3822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2423 -3.8629 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5138 8.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2638 -4.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8925 6.5573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9532 -5.0197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2462 7.0954 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.5424 3.7863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0070 -5.3244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5530 -2.9124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1958 -1.2176 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8245 9.4089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0070 -6.3244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5565 -5.1453 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.2317 2.8358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5368 -5.8244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9355 6.1449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2568 0.3967 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.8887 -4.4010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8816 0.0648 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 17.1743 -1.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5280 -0.4733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9461 -0.5539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1409 -4.8244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5350 -4.9391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5889 1.1410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5783 7.8397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1409 -6.8244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9031 -0.1414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9570 5.9386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1923 1.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2749 -5.3244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6031 -7.7906 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.2749 -6.3244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9676 -0.7601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9137 -6.8401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4850 -0.0608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2709 -8.5350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8457 -3.9886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2892 6.6829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6464 4.9881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4673 11.1037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6569 -1.7106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2998 -0.0158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9602 -9.4855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3107 6.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6678 4.7819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.5262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6784 -1.9168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3212 -0.2220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0106 -1.1725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9817 -9.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6281 -10.2298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1102 12.7985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8210 11.6418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6711 -10.6422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3174 -11.1803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3389 -11.3865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5786 5.3533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1843 5.0677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7776 5.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6670 7.2272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6784 6.1742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7286 7.4220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5642 8.2019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3463 5.4299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2679 4.4028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5808 6.2374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0596 6.9720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3250 7.4508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2680 7.7962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3925 7.8436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3451 6.9681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0497 -4.4522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9669 8.7504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1313 7.9704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2433 -3.4495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6500 -3.9818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4388 7.6847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4173 7.8909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6099 -1.6790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7176 -5.1966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3714 9.1168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2071 9.8968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9706 -5.6068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2785 -2.2960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6848 3.1278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8492 2.3479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1568 -5.8244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9561 5.5252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5493 6.0575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6708 -0.0648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1458 -7.2184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6890 -0.5245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1949 -1.6310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7881 -1.0987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9667 -1.1735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5599 -0.6412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1409 -4.2044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5063 2.2193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5556 -5.5588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1489 -5.0264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3569 -1.2688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4279 1.1922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1409 -7.4444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6392 -6.2237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7392 0.7233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5748 1.5032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7380 -5.0144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1890 -7.3292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7380 -6.6344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8178 -8.8270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6535 -8.0470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4818 7.2723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0604 4.5266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4749 9.2517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4957 8.9181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0710 -2.1721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4924 0.5736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8966 6.9382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4752 4.1926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4319 -8.5862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2105 -7.5354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7171 2.3490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3933 5.3984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6561 0.7347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8776 -0.3161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4858 -2.5061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9072 0.2395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.0168 -3.1930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.2383 -4.2438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6384 11.8992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8599 10.8484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4039 -1.3004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5677 -9.2302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2348 -10.1019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6995 12.6059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3028 13.3878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5208 12.9911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6931 12.2484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2143 11.5139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9488 11.0351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0644 -10.7701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7315 -11.6418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4423 -12.7985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 36 2 0 0 0 0 2 43 2 0 0 0 0 3 46 2 0 0 0 0 4 48 2 0 0 0 0 5 57 2 0 0 0 0 6 60 2 0 0 0 0 7 64 2 0 0 0 0 8 65 2 0 0 0 0 9 67 2 0 0 0 0 10 69 1 0 0 0 0 10162 1 0 0 0 0 11 74 2 0 0 0 0 12 75 2 0 0 0 0 13 77 2 0 0 0 0 14 96 1 0 0 0 0 14183 1 0 0 0 0 35 15 1 6 0 0 0 15 36 1 0 0 0 0 15104 1 0 0 0 0 32 16 1 6 0 0 0 16 46 1 0 0 0 0 16105 1 0 0 0 0 17 43 1 0 0 0 0 45 17 1 1 0 0 0 17118 1 0 0 0 0 40 18 1 1 0 0 0 18 57 1 0 0 0 0 18120 1 0 0 0 0 19 48 1 0 0 0 0 49 19 1 6 0 0 0 19124 1 0 0 0 0 20 51 1 0 0 0 0 20 54 1 0 0 0 0 20131 1 0 0 0 0 21 53 1 0 0 0 0 21 64 1 0 0 0 0 21138 1 0 0 0 0 58 22 1 6 0 0 0 22 60 1 0 0 0 0 22141 1 0 0 0 0 56 23 1 1 0 0 0 23 67 1 0 0 0 0 23142 1 0 0 0 0 52 24 1 6 0 0 0 24 74 1 0 0 0 0 24144 1 0 0 0 0 25 50 1 0 0 0 0 25 80 2 0 0 0 0 26 65 1 0 0 0 0 26154 1 0 0 0 0 26155 1 0 0 0 0 71 27 1 6 0 0 0 27160 1 0 0 0 0 27161 1 0 0 0 0 28 80 1 0 0 0 0 28 92 1 0 0 0 0 28 93 1 0 0 0 0 29 75 1 0 0 0 0 29164 1 0 0 0 0 29165 1 0 0 0 0 30 77 1 0 0 0 0 30168 1 0 0 0 0 30169 1 0 0 0 0 31 80 1 0 0 0 0 31170 1 0 0 0 0 31171 1 0 0 0 0 32 33 1 0 0 0 0 32 36 1 0 0 0 0 32 97 1 0 0 0 0 33 34 1 0 0 0 0 33 98 1 0 0 0 0 33 99 1 0 0 0 0 34 38 1 0 0 0 0 34 39 1 0 0 0 0 34100 1 0 0 0 0 35 37 1 0 0 0 0 35 43 1 0 0 0 0 35101 1 0 0 0 0 37 41 1 0 0 0 0 37102 1 0 0 0 0 37103 1 0 0 0 0 38106 1 0 0 0 0 38107 1 0 0 0 0 38108 1 0 0 0 0 39109 1 0 0 0 0 39110 1 0 0 0 0 39111 1 0 0 0 0 40 42 1 0 0 0 0 40 48 1 0 0 0 0 40112 1 0 0 0 0 41 50 1 0 0 0 0 41113 1 0 0 0 0 41114 1 0 0 0 0 42 44 1 0 0 0 0 42115 1 0 0 0 0 42116 1 0 0 0 0 44 47 1 0 0 0 0 44 54 2 0 0 0 0 45 55 1 0 0 0 0 45 65 1 0 0 0 0 45117 1 0 0 0 0 46 53 1 0 0 0 0 47 51 1 0 0 0 0 47 62 2 0 0 0 0 49 59 1 0 0 0 0 49 60 1 0 0 0 0 49119 1 0 0 0 0 50121 1 0 0 0 0 50122 1 0 0 0 0 51 66 2 0 0 0 0 52 57 1 0 0 0 0 52 63 1 0 0 0 0 52123 1 0 0 0 0 53125 1 0 0 0 0 53126 1 0 0 0 0 54127 1 0 0 0 0 55 68 1 0 0 0 0 55128 1 0 0 0 0 55129 1 0 0 0 0 56 61 1 0 0 0 0 56 64 1 0 0 0 0 56130 1 0 0 0 0 58 67 1 0 0 0 0 58 69 1 0 0 0 0 58132 1 0 0 0 0 59 75 1 0 0 0 0 59133 1 0 0 0 0 59134 1 0 0 0 0 61 73 1 0 0 0 0 61135 1 0 0 0 0 61136 1 0 0 0 0 62 70 1 0 0 0 0 62137 1 0 0 0 0 63 77 1 0 0 0 0 63139 1 0 0 0 0 63140 1 0 0 0 0 66 72 1 0 0 0 0 66143 1 0 0 0 0 68 78 2 0 0 0 0 68 79 1 0 0 0 0 69145 1 0 0 0 0 69146 1 0 0 0 0 70 72 2 0 0 0 0 70147 1 0 0 0 0 71 74 1 0 0 0 0 71 76 1 0 0 0 0 71148 1 0 0 0 0 72149 1 0 0 0 0 73 81 2 0 0 0 0 73 82 1 0 0 0 0 76 83 1 0 0 0 0 76150 1 0 0 0 0 76151 1 0 0 0 0 78 84 1 0 0 0 0 78152 1 0 0 0 0 79 85 2 0 0 0 0 79153 1 0 0 0 0 81 87 1 0 0 0 0 81156 1 0 0 0 0 82 88 2 0 0 0 0 82157 1 0 0 0 0 83 90 2 0 0 0 0 83 91 1 0 0 0 0 84 86 2 0 0 0 0 84158 1 0 0 0 0 85 86 1 0 0 0 0 85159 1 0 0 0 0 86163 1 0 0 0 0 87 89 2 0 0 0 0 87166 1 0 0 0 0 88 89 1 0 0 0 0 88167 1 0 0 0 0 89172 1 0 0 0 0 90 94 1 0 0 0 0 90173 1 0 0 0 0 91 95 2 0 0 0 0 91174 1 0 0 0 0 92175 1 0 0 0 0 92176 1 0 0 0 0 92177 1 0 0 0 0 93178 1 0 0 0 0 93179 1 0 0 0 0 93180 1 0 0 0 0 94 96 2 0 0 0 0 94181 1 0 0 0 0 95 96 1 0 0 0 0 95182 1 0 0 0 0 M END > 71461962 > 1 > 2650 > 16 > 17 > 39 > AAADcfB//AAAAAAAAAAAAAAAAAAAAWAAAAAwYMGAAAAAAFgB9AAAHgAQCAAADSzhngY/xvPJkgCoAzV3dACCgCExIiAJ2aG+bJiKdv7C0bOUcAhm9hHY2AedyeCOoAAAAAACAABAAAAAAAQAAAAAAAAAAA== > (2S)-N-[(1S)-2-[[(1S)-3-amino-1-[[(1S)-2-[[(1S)-2-[[2-[[(1S)-1-[[(1S)-1-[[(1S)-2-amino-1-benzyl-2-oxo-ethyl]carbamoyl]-4-[[amino(dimethylamino)methylene]amino]butyl]carbamoyl]-3-methyl-butyl]amino]-2-oxo-ethyl]amino]-1-benzyl-2-oxo-ethyl]amino]-1-(hydroxymethyl)-2-oxo-ethyl]carbamoyl]-3-oxo-propyl]amino]-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]butanediamide > (2S)-N-[(2S)-1-[[(2S)-4-amino-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-5-[[amino(dimethylamino)methylidene]amino]-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]butanediamide > (2S)-N-[(2S)-1-[[(2S)-4-amino-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-5-[[amino(dimethylamino)methylidene]amino]-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]butanediamide > (2S)-N-[(2S)-1-[[(2S)-4-amino-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-5-[[amino(dimethylamino)methylidene]amino]-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]butanediamide > (2S)-N-[(2S)-1-[[(2S)-4-azanyl-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-5-[[azanyl(dimethylamino)methylidene]amino]-1-[[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-2-oxidanylidene-ethyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-1,4-bis(oxidanylidene)butan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-2-[[(2S)-2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]butanediamide > (2S)-N-[(1S)-2-[[(1S)-3-amino-1-[[(1S)-2-[[(1S)-2-[[2-[[(1S)-1-[[(1S)-1-[[(1S)-2-amino-1-benzyl-2-keto-ethyl]carbamoyl]-4-[[amino(dimethylamino)methylene]amino]butyl]carbamoyl]-3-methyl-butyl]amino]-2-keto-ethyl]amino]-1-benzyl-2-keto-ethyl]amino]-2-keto-1-methylol-ethyl]carbamoyl]-3-keto-propyl]amino]-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]succinamide > InChI=1S/C65H87N17O14/c1-36(2)26-47(60(92)75-45(20-13-25-71-65(70)82(3)4)59(91)76-46(56(69)88)28-37-14-7-5-8-15-37)74-55(87)34-73-58(90)48(29-38-16-9-6-10-17-38)78-64(96)52(35-83)81-63(95)51(32-54(68)86)80-61(93)49(30-40-33-72-44-19-12-11-18-42(40)44)79-62(94)50(31-53(67)85)77-57(89)43(66)27-39-21-23-41(84)24-22-39/h5-12,14-19,21-24,33,36,43,45-52,72,83-84H,13,20,25-32,34-35,66H2,1-4H3,(H2,67,85)(H2,68,86)(H2,69,88)(H2,70,71)(H,73,90)(H,74,87)(H,75,92)(H,76,91)(H,77,89)(H,78,96)(H,79,94)(H,80,93)(H,81,95)/t43-,45-,46-,47-,48-,49-,50-,51-,52-/m0/s1 > OCPWMJLUGMDFNB-NSWSVTGLSA-N > -1.3 > 1329.66184052 > C65H87N17O14 > 1330.5 > CC(C)CC(C(=O)NC(CCCN=C(N)N(C)C)C(=O)NC(CC1=CC=CC=C1)C(=O)N)NC(=O)CNC(=O)C(CC2=CC=CC=C2)NC(=O)C(CO)NC(=O)C(CC(=O)N)NC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)C(CC(=O)N)NC(=O)C(CC5=CC=C(C=C5)O)N > CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N)NC(=O)CNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC5=CC=C(C=C5)O)N > 515 > 1329.66184052 > 0 > 96 > 9 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 35 15 6 32 16 6 45 17 5 40 18 5 49 19 6 20 51 8 20 54 8 58 22 6 56 23 5 52 24 6 71 27 6 44 47 8 44 54 8 47 51 8 47 62 8 51 66 8 62 70 8 66 72 8 68 78 8 68 79 8 70 72 8 73 81 8 73 82 8 78 84 8 79 85 8 81 87 8 82 88 8 83 90 8 83 91 8 84 86 8 85 86 8 87 89 8 88 89 8 90 94 8 91 95 8 94 96 8 95 96 8 $$$$