B9ZHU8 -OEChem-04012113113D 29 31 0 0 0 0 0 0 0999 V2000 -5.1606 -2.2351 0.7158 I 0 0 0 0 0 0 0 0 0 0 0 0 0.6038 3.0106 -0.2278 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9871 2.8867 0.9724 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 0.7504 -0.7749 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -0.0796 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2999 0.3398 -1.4852 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9778 0.6113 0.1778 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0848 2.0134 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4655 1.9608 0.4002 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3415 -0.2369 -0.5679 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1936 -1.3994 -0.8936 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1758 0.0426 0.5544 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4014 -2.0034 -0.5246 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3822 -1.2894 0.1919 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 0.6009 0.0056 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3439 -1.6007 -0.3036 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2566 0.0659 0.8571 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3105 -2.1355 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2668 -1.3023 1.1283 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7161 1.2211 -1.9906 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0404 -0.3644 -2.2845 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4688 -1.9641 -1.4654 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9142 0.6140 1.1059 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5691 -3.0399 -0.8096 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2925 1.6679 -0.1977 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6233 -2.2705 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0014 0.7145 1.3089 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3216 -3.2016 0.7557 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0201 -1.7191 1.7905 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 2 8 2 0 0 0 0 3 9 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 5 7 2 0 0 0 0 5 11 1 0 0 0 0 6 10 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 10 15 2 0 0 0 0 10 16 1 0 0 0 0 11 13 2 0 0 0 0 11 22 1 0 0 0 0 12 14 2 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 15 17 1 0 0 0 0 15 25 1 0 0 0 0 16 18 2 0 0 0 0 16 26 1 0 0 0 0 17 19 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 19 29 1 0 0 0 0 M END $$$$