B82EAW -OEChem-04012115323D 37 37 0 1 0 0 0 0 0999 V2000 -1.9320 -3.0386 -0.3851 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6485 -2.9434 0.7304 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8019 0.1042 1.5445 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7728 2.8878 -1.5505 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2237 4.0472 0.1268 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4946 0.9348 -0.1942 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5876 -0.5883 -0.4648 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1418 -1.4409 1.1563 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5309 -1.6941 -1.0754 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2159 -0.6714 -0.6813 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6716 1.8266 0.5830 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5937 1.1448 1.1114 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2649 -1.5983 -1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3602 -1.4802 -0.0721 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4938 0.1466 0.3563 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5235 0.6086 0.0164 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7368 -0.0922 0.6182 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3597 3.0449 -0.2656 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6780 -1.1981 -0.1175 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6444 0.0511 -1.3893 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2724 2.1792 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1519 1.8577 1.7315 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3021 0.3147 1.7676 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7426 -1.9575 -2.3553 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3153 -1.1394 -1.7223 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9504 -0.9084 0.6507 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0414 -1.8238 -0.8582 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8609 1.4284 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9838 -0.0969 -0.6268 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3446 0.9116 -1.1985 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3989 -0.9251 1.2467 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2904 0.6195 1.2428 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5545 3.6687 -2.1026 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 -1.1440 1.9824 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0163 -1.9317 1.3091 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3247 -1.5927 -2.0632 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3884 -2.1741 -0.8248 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 2 14 1 0 0 0 0 3 15 2 0 0 0 0 4 18 1 0 0 0 0 4 33 1 0 0 0 0 5 18 2 0 0 0 0 6 11 1 0 0 0 0 6 15 1 0 0 0 0 6 30 1 0 0 0 0 7 17 1 0 0 0 0 7 19 2 0 0 0 0 8 19 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 19 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 11 21 1 0 0 0 0 12 16 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 M END $$$$