B1V3AD -OEChem-04022117223D 31 33 0 0 0 0 0 0 0999 V2000 -6.3299 -0.6641 -0.3857 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.9278 0.8038 1.1963 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0063 -0.6881 -0.4482 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6519 1.5720 -0.5802 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9609 2.1952 -0.2627 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9854 -1.8091 0.3347 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5311 -0.0040 0.3220 N 0 3 0 0 0 0 0 0 0 0 0 0 6.2508 -1.1486 0.6414 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -0.1065 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0151 0.2912 -0.3831 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -0.5198 -0.2586 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2899 0.9054 -0.0705 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 -1.4325 0.0835 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2996 -1.2396 -1.0294 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 0.3764 0.7111 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6011 0.5271 0.1878 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1352 -0.1769 0.1275 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6707 -1.0698 -0.8384 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2283 0.5463 0.9022 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8978 -0.8165 0.3802 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6599 2.4578 -0.5069 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2554 -1.5215 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0138 -2.2604 0.0624 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9548 -1.9396 -1.7875 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1754 0.9401 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3828 1.2812 0.2383 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3479 -1.6497 -1.4603 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5538 1.2474 1.6666 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4008 3.4983 -0.6606 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9751 -0.5465 0.2692 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4649 -2.1291 0.7755 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 2 7 2 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 3 22 1 0 0 0 0 4 10 2 0 0 0 0 4 21 1 0 0 0 0 5 12 1 0 0 0 0 5 21 2 0 0 0 0 6 13 1 0 0 0 0 6 20 2 0 0 0 0 7 17 1 0 0 0 0 8 20 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 13 2 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 16 2 0 0 0 0 13 23 1 0 0 0 0 14 18 1 0 0 0 0 14 24 1 0 0 0 0 15 19 2 0 0 0 0 15 25 1 0 0 0 0 16 20 1 0 0 0 0 16 26 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 27 1 0 0 0 0 19 28 1 0 0 0 0 21 29 1 0 0 0 0 M CHG 2 1 -1 7 1 M END $$$$