BAI1N5 -OEChem-04022102352D 33 36 0 0 0 0 0 0 0999 V2000 5.2152 -2.8103 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9423 0.5545 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.2988 -2.8716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2988 -1.1395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.5055 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4721 0.0545 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.5055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.5055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.5055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2152 -1.2008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7988 -2.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5259 -0.2503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5259 1.3592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4764 1.0485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7988 -2.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3196 2.3377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2207 1.7164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0640 3.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0145 2.6949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 -0.5306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 -0.5306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3249 -0.9229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9264 -1.6132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 -3.4805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 -3.4805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7303 2.5303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8100 1.5238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9361 3.6122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4759 3.1089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9188 -2.8716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 13 1 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 3 17 1 0 0 0 0 3 33 1 0 0 0 0 4 17 2 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 28 1 0 0 0 0 6 14 2 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 7 12 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 11 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 13 17 1 0 0 0 0 15 16 1 0 0 0 0 15 18 2 0 0 0 0 16 19 2 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 19 21 1 0 0 0 0 19 30 1 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 21 32 1 0 0 0 0 M END $$$$