D0H2OA -OEChem-10101305032D 28 27 0 1 0 0 0 0 0999 V2000 5.4641 -1.5675 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.3355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 1.0306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.1645 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.1645 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9641 -0.7015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.6645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.1645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.6645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4390 -1.1000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4390 -0.3030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.2845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2741 1.5675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3441 1.0306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.4555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 1.1395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 1.1395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 -0.8104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -0.8104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.7015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.4745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.3724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.4745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.4555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 2 9 1 0 0 0 0 2 12 1 0 0 0 0 3 9 2 0 0 0 0 4 6 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 5 11 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 7 14 1 0 0 0 0 7 15 1 0 0 0 0 8 10 2 0 0 0 0 8 16 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 M END $$$$