BW3D4X -OEChem-04012113182D 27 27 0 0 0 0 0 0 0999 V2000 3.7320 0.9400 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 0.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 0.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.4769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 -0.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 0.4769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 2.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 10 1 0 0 0 0 7 12 1 0 0 0 0 8 11 2 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 10 15 1 0 0 0 0 11 16 1 0 0 0 0 12 17 1 0 0 0 0 12 18 1 0 0 0 0 12 19 1 0 0 0 0 13 20 1 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 14 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 M END $$$$