B1V4NB -OEChem-04022103263D 25 25 0 0 0 0 0 0 0999 V2000 -3.1403 1.0544 0.1212 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 2.7790 -0.8416 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5987 0.5521 0.2207 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -1.3208 0.0716 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1831 -1.0316 0.0241 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2794 -3.1758 -0.0759 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6515 2.2244 0.2568 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7558 -0.2885 0.2034 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 0.0549 0.1563 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0434 -0.7289 -1.2261 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9355 0.4691 0.7985 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7553 0.8965 0.1761 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 0.3424 0.1062 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0548 -1.8271 0.0088 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6002 -1.1777 0.8276 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7252 1.5588 0.2226 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1975 0.1339 -1.8844 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -1.3189 -1.6469 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9468 -1.3470 -1.2656 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1652 1.3718 0.2209 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 0.7813 1.8264 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8329 -0.1581 0.8172 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0924 -1.4810 -0.0271 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5098 -3.8361 -0.0933 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2193 -3.5537 -0.1239 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 7 2 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 16 1 0 0 0 0 4 9 1 0 0 0 0 4 14 2 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 5 23 1 0 0 0 0 6 14 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 12 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 15 1 0 0 0 0 9 12 2 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 M END $$$$