BA37NI -OEChem-04022114473D 32 33 0 0 0 0 0 0 0999 V2000 -4.8406 1.4308 -0.4246 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.2704 2.6727 0.4237 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.2526 2.2030 -1.6935 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7519 -0.5831 -1.2768 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1434 -3.7953 -0.3553 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1598 -3.3208 1.7879 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6461 -1.0324 -2.0051 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8482 -0.5733 0.0636 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4651 -3.0536 0.6022 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5560 -0.6587 0.0712 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2026 -1.8664 0.3338 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7435 0.4750 0.3727 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6965 0.4317 -0.1852 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3029 0.4904 -0.1882 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5963 -1.9252 0.3367 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3432 -0.7761 0.0772 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9847 0.5658 -0.2571 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3714 1.4273 1.3215 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4956 1.6596 -0.4642 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8539 1.6090 0.0618 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2406 2.4707 1.6404 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4819 2.5615 1.0106 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4027 -0.4126 -1.2534 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3107 -1.4318 -0.2195 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8204 1.4363 -0.4212 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1145 -2.8594 0.5397 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4276 -0.8432 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4229 1.3698 1.8483 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8222 1.7162 -0.4201 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9534 3.2095 2.3829 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1577 3.3750 1.2579 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0251 -1.2425 -1.9498 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 19 1 0 0 0 0 3 19 1 0 0 0 0 4 23 1 0 0 0 0 4 32 1 0 0 0 0 5 9 1 0 0 0 0 6 9 2 0 0 0 0 7 23 2 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 8 24 1 0 0 0 0 9 11 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 15 1 0 0 0 0 12 17 1 0 0 0 0 12 18 2 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 13 19 1 0 0 0 0 14 25 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 17 20 2 0 0 0 0 17 23 1 0 0 0 0 18 21 1 0 0 0 0 18 28 1 0 0 0 0 20 22 1 0 0 0 0 20 29 1 0 0 0 0 21 22 2 0 0 0 0 21 30 1 0 0 0 0 22 31 1 0 0 0 0 M CHG 2 5 -1 9 1 M END $$$$