BD3BJ5 -OEChem-04012115063D 55 57 0 0 0 0 0 0 0999 V2000 2.9154 0.4775 0.6473 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5222 0.8025 -0.9611 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6037 -3.8941 -0.6451 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5466 2.6676 -0.4248 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7614 -0.8140 0.6859 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4246 -2.6935 0.2324 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1317 1.5167 0.0745 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3359 2.2051 1.1794 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 0.9396 -0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 3.2199 0.6014 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2113 1.9963 -1.4896 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5776 1.8048 0.1475 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7755 1.6835 -0.7951 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 0.8130 -0.2065 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7528 -0.5643 -0.2012 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6612 -1.4448 -0.7207 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0476 -1.3342 0.2828 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7630 -1.3499 0.3477 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1096 0.2090 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0031 1.3859 0.3541 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1831 -2.8487 -0.3943 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9036 -0.8108 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0172 0.5808 0.9061 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4612 -2.4593 1.2384 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9421 -1.8792 -1.1455 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0877 -0.2092 0.3335 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7749 2.2794 -0.3851 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0242 2.7047 1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8059 1.4556 1.7813 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6635 0.0685 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7833 0.5548 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2318 3.6785 1.4119 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9147 4.0456 0.1511 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7771 2.7648 -2.0334 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4476 1.5524 -2.2426 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9519 2.2546 1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1834 0.8260 0.4367 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4957 1.2603 -1.7661 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1820 2.6803 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5422 -1.3445 -1.8025 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7187 -1.2889 -0.1918 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1253 2.4664 0.3731 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3022 -1.2174 1.4974 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0096 -3.4515 0.5634 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6827 -1.4333 1.3314 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8980 1.0500 1.3365 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5315 -2.0959 2.2703 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7279 -3.2742 1.2303 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4345 -2.8805 0.9632 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -1.0998 -1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1376 -2.6196 -1.2271 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8756 -2.3711 -1.4433 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8970 0.5824 -0.3974 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1138 0.2595 1.3243 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0914 -0.5979 0.1245 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 19 1 0 0 0 0 2 19 2 0 0 0 0 3 21 2 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 5 17 1 0 0 0 0 5 19 1 0 0 0 0 5 43 1 0 0 0 0 6 18 1 0 0 0 0 6 21 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 27 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 21 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 24 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 18 22 2 0 0 0 0 20 23 2 0 0 0 0 20 42 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 M END $$$$