B5P1MN -OEChem-04022102013D 57 60 0 0 0 0 0 0 0999 V2000 3.0818 -0.9774 -1.0040 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2583 -3.2944 -0.0045 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2754 -0.1795 -0.4668 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3404 -0.1737 1.9791 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9613 -1.5129 0.0257 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4228 -1.1535 -2.4097 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1689 0.4153 -0.2791 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7308 -0.9149 1.4806 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3733 -0.5881 0.8606 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4451 -0.4822 1.8309 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5803 -1.9832 1.1944 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6169 -2.8786 -0.0371 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6602 1.4900 0.0066 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4823 1.4904 0.7391 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2380 0.1485 0.0784 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2901 0.1492 1.2898 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3189 -2.8396 -0.8346 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 0.7775 -0.7723 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5034 -1.6629 -0.7085 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6002 1.3984 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1169 2.6185 -0.6424 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6989 2.6196 0.8611 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0187 -2.7577 -0.2363 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3678 0.6119 1.3258 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5943 -1.7981 -1.7578 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1515 -2.0750 0.5768 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2758 1.5394 -1.7016 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6668 -2.3454 -1.5216 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1096 -2.6223 0.8129 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5082 2.7813 0.4713 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3397 3.7752 -0.5319 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1422 3.7756 0.2123 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1837 2.9223 -1.5444 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8000 3.5433 -0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7473 0.1834 0.8511 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5482 -2.0519 1.7045 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8092 -2.3130 1.8989 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7967 -3.9066 0.3013 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4506 -2.6094 -0.6941 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4037 -3.5114 -1.6965 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1623 -1.8172 -1.1997 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0368 2.6183 -1.2151 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7778 2.6200 1.4321 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7839 -0.1964 1.7766 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5601 1.2674 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8483 -1.4859 -2.7668 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8387 -1.9726 1.4116 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7886 1.0746 -2.5542 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3333 -2.4602 -2.3713 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -2.9387 1.8166 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9836 3.2841 1.3093 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6607 4.6882 -1.0266 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5569 4.6889 0.2806 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 3.5157 -2.2677 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7286 4.6201 -0.3361 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1728 -0.5799 2.8022 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5378 -1.8304 1.2159 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 17 1 0 0 0 0 2 23 1 0 0 0 0 3 15 2 0 0 0 0 4 16 2 0 0 0 0 7 35 2 0 0 0 0 8 10 1 0 0 0 0 8 57 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 9 16 1 0 0 0 0 10 35 1 0 0 0 0 10 56 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 17 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 2 0 0 0 0 14 16 1 0 0 0 0 14 22 2 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 20 1 0 0 0 0 18 27 2 0 0 0 0 19 25 2 0 0 0 0 19 26 1 0 0 0 0 20 24 1 0 0 0 0 20 30 2 0 0 0 0 21 31 1 0 0 0 0 21 42 1 0 0 0 0 22 32 1 0 0 0 0 22 43 1 0 0 0 0 23 28 2 0 0 0 0 23 29 1 0 0 0 0 24 35 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 28 1 0 0 0 0 25 46 1 0 0 0 0 26 29 2 0 0 0 0 26 47 1 0 0 0 0 27 33 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 30 34 1 0 0 0 0 30 51 1 0 0 0 0 31 32 2 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 33 34 2 0 0 0 0 33 54 1 0 0 0 0 34 55 1 0 0 0 0 M END $$$$