BC3H4K -OEChem-04022106393D 29 31 0 0 0 0 0 0 0999 V2000 -4.9570 0.0641 -1.1184 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.8007 -1.7665 -0.7564 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4112 -0.5264 1.0612 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -1.7554 0.8050 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2641 -1.6483 0.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9121 -0.5140 -0.7230 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5759 0.3556 0.7089 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7157 -0.2790 1.6143 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6666 -0.3468 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7469 -0.1042 0.5326 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8382 0.2619 -0.2302 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6293 1.7555 0.7742 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8787 1.6588 -0.1597 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7958 2.3937 0.3328 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0065 1.1647 0.0148 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4430 -1.2112 0.0471 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9621 1.3268 -0.9883 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3988 -1.0492 -0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6581 0.2198 -1.4737 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9747 -1.1180 2.2715 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6611 0.6095 2.2536 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1988 2.3389 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7584 2.2085 -0.4881 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8596 3.4780 0.3763 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 2.0384 0.3871 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2495 -2.2051 0.4415 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1656 2.3151 -1.3902 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9407 -1.9112 -1.3341 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4025 0.3459 -2.2545 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 $$$$