B8GHW4 -OEChem-04022106513D 48 50 0 0 0 0 0 0 0999 V2000 2.6558 2.4940 -0.5087 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5242 -2.2455 0.8257 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.1493 2.6339 -1.1992 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3901 2.3269 -1.9313 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4429 3.6373 -0.0675 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2995 -3.3722 0.3408 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3135 -2.0760 2.2505 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1730 -3.3107 -0.7963 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2907 -2.2106 -2.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1498 2.4707 0.3259 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0143 -2.2054 -0.0031 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4324 1.0321 0.0595 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7948 0.8808 1.3979 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3458 1.2812 0.2422 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6872 0.0076 -0.8522 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -1.0254 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 -1.1684 -0.4254 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4120 -0.2952 1.8245 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 0.5805 1.4017 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1029 0.8285 -0.9986 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7665 -0.5727 1.3208 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8832 -0.3248 -1.0796 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5362 1.9582 2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6664 -1.3199 0.9129 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3118 -0.7817 0.2179 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1035 -0.8403 -0.9291 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1408 0.4308 0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5681 -2.2376 -1.3756 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7243 0.3135 -1.4079 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7614 1.5846 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5532 1.5259 -0.7398 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0859 2.9902 1.2097 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4098 0.1119 -1.8974 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7007 -0.4309 2.8635 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3585 0.9203 2.3745 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 1.3711 -1.9139 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9903 -2.6810 -0.9146 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9861 -1.1137 2.2359 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2349 -0.6632 -2.0508 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9124 1.6643 3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 2.1511 2.5396 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0673 2.8797 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1481 -2.2186 1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2442 -1.7720 -1.4695 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5358 0.5010 1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3394 0.2687 -2.3018 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6294 2.5285 0.9276 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3472 -4.0256 -1.4451 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 10 1 0 0 0 0 1 12 1 0 0 0 0 2 6 2 0 0 0 0 2 7 2 0 0 0 0 2 11 1 0 0 0 0 2 25 1 0 0 0 0 3 31 1 0 0 0 0 8 28 1 0 0 0 0 8 48 1 0 0 0 0 9 28 2 0 0 0 0 10 14 1 0 0 0 0 10 32 1 0 0 0 0 11 16 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 18 1 0 0 0 0 13 23 1 0 0 0 0 14 19 2 0 0 0 0 14 20 1 0 0 0 0 15 17 2 0 0 0 0 15 33 1 0 0 0 0 16 21 2 0 0 0 0 16 22 1 0 0 0 0 17 24 1 0 0 0 0 17 28 1 0 0 0 0 18 24 2 0 0 0 0 18 34 1 0 0 0 0 19 21 1 0 0 0 0 19 35 1 0 0 0 0 20 22 2 0 0 0 0 20 36 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 29 1 0 0 0 0 26 44 1 0 0 0 0 27 30 2 0 0 0 0 27 45 1 0 0 0 0 29 31 2 0 0 0 0 29 46 1 0 0 0 0 30 31 1 0 0 0 0 30 47 1 0 0 0 0 M END $$$$