L0QU7T -OEChem-05022323123D 35 38 0 0 0 0 0 0 0999 V2000 -3.9004 -0.6309 0.0551 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5502 0.5862 0.9809 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1286 -0.6131 -0.0689 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4335 -2.8515 0.0773 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0174 -2.6822 0.0094 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6996 0.7007 -0.0478 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7739 1.8810 -0.0892 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5068 3.1722 -0.4845 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8360 3.3210 0.2684 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7968 2.1637 -0.0431 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0733 0.8538 -0.0052 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3187 -0.6828 -0.0168 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4382 -1.5048 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0796 -1.3342 -0.0286 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4134 -1.2448 -0.0819 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1854 -3.3508 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5319 -0.2432 -0.0776 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5433 -0.0072 -0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2681 1.0711 -0.3849 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6243 1.3957 0.7863 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3073 2.0085 0.8947 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0128 1.7316 -0.8351 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8622 4.0350 -0.2823 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7063 3.1675 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3122 4.2721 0.0046 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6350 3.3518 1.3471 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2212 2.3051 -1.0448 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6264 2.1773 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0981 0.3878 0.0489 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5095 -1.8813 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5307 -1.8884 0.7987 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1084 -4.4320 0.0886 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7509 -0.5300 -1.8684 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1495 1.5517 -0.7842 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7952 2.1375 1.5528 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 13 1 0 0 0 0 2 17 1 0 0 0 0 2 20 1 0 0 0 0 3 14 1 0 0 0 0 3 15 1 0 0 0 0 3 29 1 0 0 0 0 4 13 2 0 0 0 0 4 16 1 0 0 0 0 5 14 1 0 0 0 0 5 16 2 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 15 17 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 M END $$$$