BJ2VE8 -OEChem-04022115303D 45 48 0 0 0 0 0 0 0999 V2000 1.9074 -1.2503 -1.2196 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5136 -1.2395 0.0428 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8125 -1.4593 -2.3345 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0437 -0.0871 -1.1799 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1395 2.7579 2.6894 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0048 -2.6961 -0.9729 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2076 1.0565 1.4312 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9743 3.1164 0.5000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -1.2439 0.2565 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7676 1.0284 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6248 2.2899 -0.4162 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3756 -0.0118 -0.5115 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7712 -0.0265 0.2149 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1128 -2.6504 -0.0856 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3615 -1.9204 0.4114 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2697 -1.9647 -0.4554 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0826 2.5777 -1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8491 0.2563 -1.7997 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6988 2.3634 1.6765 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0477 -3.2923 1.1512 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7043 1.5365 -2.3784 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2210 1.2335 0.4495 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1331 -0.1529 -0.0584 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2965 -2.5621 1.6481 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1396 -3.2481 2.0181 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0325 2.3674 0.4105 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9447 0.9808 -0.0974 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3945 2.2410 0.1371 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4857 -2.1680 0.2813 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2436 -1.2113 1.1308 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5682 -3.5531 -0.8898 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1778 0.2771 2.0759 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3199 -1.4938 -1.4341 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7425 4.0891 0.3415 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 3.5598 -2.1253 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3375 -0.5287 -2.3725 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8491 -3.8286 1.4505 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0829 1.7125 -3.3821 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1672 1.3508 0.6867 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5747 -1.1282 -0.2446 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1439 -2.5301 2.3274 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0888 -3.7471 2.9814 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6050 3.3480 0.5983 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0052 0.8825 -0.3104 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0267 3.1236 0.1079 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 6 1 0 0 0 0 1 9 1 0 0 0 0 2 12 1 0 0 0 0 2 15 1 0 0 0 0 5 19 2 0 0 0 0 6 14 1 0 0 0 0 6 31 1 0 0 0 0 7 10 1 0 0 0 0 7 19 1 0 0 0 0 7 32 1 0 0 0 0 8 11 1 0 0 0 0 8 19 1 0 0 0 0 8 34 1 0 0 0 0 9 13 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 11 17 1 0 0 0 0 12 18 2 0 0 0 0 13 22 2 0 0 0 0 13 23 1 0 0 0 0 14 16 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 33 1 0 0 0 0 17 21 2 0 0 0 0 17 35 1 0 0 0 0 18 21 1 0 0 0 0 18 36 1 0 0 0 0 20 25 2 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 26 1 0 0 0 0 22 39 1 0 0 0 0 23 27 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 26 28 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 M END $$$$