B0BJ9M -OEChem-04022113393D 57 61 0 0 0 0 0 0 0999 V2000 0.2716 -0.5586 1.6695 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9022 2.4311 -0.3342 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.8505 2.2141 0.0147 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4533 -0.2402 -0.2632 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0852 -1.3290 0.6691 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1229 -1.6156 -0.6498 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2894 -0.4913 0.1577 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0440 1.7060 -0.7754 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3188 0.8531 0.1789 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0126 -1.8801 -0.3003 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2191 0.2895 -0.8577 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1575 -1.1459 0.8546 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3270 -0.8416 -1.3791 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2989 -2.3289 0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6948 1.7472 -1.0061 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5852 0.3157 0.8526 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6940 2.8131 -0.5699 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5349 1.4610 1.1859 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7243 -1.2277 0.4505 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6494 -0.7962 0.6604 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2393 -1.3752 -0.5444 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9961 -0.4924 0.9165 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2138 -1.6595 -1.5257 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9403 -0.7837 -0.0714 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5564 -1.3598 -1.2773 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7581 0.6810 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2131 0.9211 0.0872 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1370 0.0720 0.6557 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4275 0.6691 0.7467 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4408 1.9516 0.2443 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7852 1.4715 0.9162 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5576 -2.7623 -0.7684 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6636 0.9051 -0.1383 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4218 0.9097 -1.7349 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0651 -1.6107 1.2503 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6699 -0.6141 1.6811 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8428 -1.3427 -2.2094 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4079 -0.4148 -1.7978 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0645 -2.9654 1.2583 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8842 -2.9434 -0.3012 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1456 1.1392 -1.8012 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8368 2.2784 -1.4271 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3764 -0.1969 1.7965 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0948 -0.3875 0.1813 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2455 3.5134 0.1449 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0229 3.3929 -1.4382 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4722 1.0629 1.5877 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1070 2.1281 1.9436 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4681 -0.9724 1.5401 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2948 -0.0428 1.8593 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9248 -2.1093 -2.4713 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2975 -1.5839 -2.0409 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4837 2.5889 -1.0139 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0574 1.6185 -0.9924 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9099 -0.9312 0.9939 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3016 0.1826 1.1597 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2805 2.6299 0.1891 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 27 1 0 0 0 0 2 30 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 9 1 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 5 10 1 0 0 0 0 5 19 1 0 0 0 0 5 49 1 0 0 0 0 6 19 2 0 0 0 0 6 21 1 0 0 0 0 7 24 1 0 0 0 0 7 26 2 0 0 0 0 8 26 1 0 0 0 0 8 53 1 0 0 0 0 8 54 1 0 0 0 0 9 15 1 0 0 0 0 9 16 1 0 0 0 0 9 31 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 10 32 1 0 0 0 0 11 13 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 14 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 17 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 18 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 22 24 2 0 0 0 0 22 50 1 0 0 0 0 23 25 2 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 30 2 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 M END $$$$