BC3H4K -OEChem-04012117492D 29 31 0 0 0 0 0 0 0999 V2000 2.0000 2.8091 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7320 2.8091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.4956 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 0.3091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 1.1138 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.3091 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -1.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.8091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -1.6524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.6909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.8091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 -2.6029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6353 -0.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 -2.8091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6138 -1.1143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9244 -2.0648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 -1.5335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 -2.0658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.1191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.5009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8640 -3.0644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4427 -0.3187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4492 -3.3984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0279 -0.6528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5311 -2.1927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 2 6 2 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 5 9 1 0 0 0 0 6 11 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 20 1 0 0 0 0 8 21 1 0 0 0 0 9 11 1 0 0 0 0 10 15 2 0 0 0 0 10 16 1 0 0 0 0 11 13 2 0 0 0 0 12 14 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 15 17 1 0 0 0 0 15 25 1 0 0 0 0 16 18 2 0 0 0 0 16 26 1 0 0 0 0 17 19 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 19 29 1 0 0 0 0 M CHG 2 1 -1 6 1 M END $$$$