B8AY2O
-OEChem-04022104313D
26 25 0 0 0 0 0 0 0999 V2000
4.8532 -0.3317 -0.0086 I 0 0 0 0 0 0 0 0 0 0 0 0
-2.0127 -0.0352 -0.0009 N 0 3 0 0 0 0 0 0 0 0 0 0
-0.6716 -0.7538 -0.0346 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4471 0.2769 -0.0025 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1140 0.9063 -1.1923 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1378 -1.0580 -0.0656 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1277 0.7646 1.2887 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8187 -0.4011 0.0121 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9447 0.6321 0.0038 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6291 -1.4240 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6360 -1.3551 -0.9507 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3968 0.9134 0.8852 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4205 0.9260 -0.8831 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8443 0.3577 -2.0996 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1511 1.2508 -1.2616 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4710 1.7772 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0471 -1.7254 0.7966 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0951 -0.5290 -0.0389 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0397 -1.6207 -0.9987 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8639 0.1176 2.1304 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4872 1.6486 1.2473 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1666 1.0962 1.3874 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9008 -1.0394 0.9009 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9079 -1.0582 -0.8623 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8696 1.2777 0.8858 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8600 1.2750 -0.8795 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 1 0 0 0 0
2 3 1 0 0 0 0
2 5 1 0 0 0 0
2 6 1 0 0 0 0
2 7 1 0 0 0 0
3 4 1 0 0 0 0
3 10 1 0 0 0 0
3 11 1 0 0 0 0
4 8 1 0 0 0 0
4 12 1 0 0 0 0
4 13 1 0 0 0 0
5 14 1 0 0 0 0
5 15 1 0 0 0 0
5 16 1 0 0 0 0
6 17 1 0 0 0 0
6 18 1 0 0 0 0
6 19 1 0 0 0 0
7 20 1 0 0 0 0
7 21 1 0 0 0 0
7 22 1 0 0 0 0
8 9 1 0 0 0 0
8 23 1 0 0 0 0
8 24 1 0 0 0 0
9 25 1 0 0 0 0
9 26 1 0 0 0 0
M CHG 1 2 1
M END
$$$$