B2BWX3 -OEChem-04042105493D 21 21 0 0 0 0 0 0 0999 V2000 -4.5087 -0.4360 0.6208 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -0.3097 0.0221 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 1.7794 -0.3210 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3804 -2.5306 -0.5346 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6335 0.5567 0.0933 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2801 0.1489 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3506 0.6717 -1.0976 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7884 0.8615 0.1187 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6437 -0.1438 1.2359 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7142 0.3789 -1.1217 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3608 -0.0286 0.0451 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8018 -0.0199 -0.0703 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2079 0.4761 0.0753 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 -1.4046 -0.3261 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7354 0.0547 2.1964 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 0.9885 -2.0154 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9819 1.9007 0.3742 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1475 -0.4613 2.1441 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2729 0.4684 -2.0487 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6751 2.3646 -0.7258 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3196 2.2007 -0.2623 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 11 1 0 0 0 0 3 13 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 14 3 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 6 9 1 0 0 0 0 6 15 1 0 0 0 0 7 10 2 0 0 0 0 7 16 1 0 0 0 0 8 12 2 0 0 0 0 8 17 1 0 0 0 0 9 11 2 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 M END $$$$