B1V3AD -OEChem-04022103082D 31 33 0 0 0 0 0 0 0999 V2000 9.4466 -3.3472 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 10.3299 -1.8573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0174 -0.3074 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 1.2064 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0290 2.7619 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.2272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4581 -2.3473 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5369 2.7272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.2272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0290 0.6926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8776 -0.8174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.2272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.7272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7493 -0.3274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8660 -1.8173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.7272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5980 -1.8373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6095 -0.8374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7262 -2.3273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.2272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 2.2480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4769 -0.6111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.1072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7565 0.2926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3255 -2.1210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.3472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1500 -0.5336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7190 -2.9472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4708 2.5601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.4172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 3.3472 0.0000 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 $$$$