B17VLI -OEChem-04012112442D 53 56 0 0 0 0 0 0 0999 V2000 15.7882 -1.0530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.9470 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2045 -1.8577 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -1.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2045 -0.2482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7882 -1.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -2.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -1.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 1.0547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 0.3644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 2.9220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 2.9220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -0.0279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -0.0279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 1.8394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 2.5296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 2.9220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 2.9220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 -0.0279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 -0.0279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3267 1.4220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 1.4220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.0670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.6370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.6370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7419 0.0610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9535 0.3187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 0.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3972 -2.4470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -2.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9893 -1.8630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 2 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 2 10 1 0 0 0 0 3 21 1 0 0 0 0 3 25 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 28 1 0 0 0 0 5 7 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 8 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 11 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 12 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 12 15 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 16 1 0 0 0 0 13 43 1 0 0 0 0 14 17 2 0 0 0 0 14 44 1 0 0 0 0 15 20 3 0 0 0 0 16 18 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 47 1 0 0 0 0 19 21 2 0 0 0 0 19 23 1 0 0 0 0 19 24 1 0 0 0 0 20 22 1 0 0 0 0 21 26 1 0 0 0 0 22 24 2 0 0 0 0 22 27 1 0 0 0 0 23 25 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 M END $$$$