BH7PT3 -OEChem-04012115392D 58 60 0 0 0 0 0 0 0999 V2000 6.3301 -1.3170 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.1830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.3170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.8170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.1830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -3.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8923 -1.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8923 -3.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.3730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 1.6004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 2.2907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 2.2907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 1.6004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 3.0753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 3.7656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 3.7656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 3.0753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 4.1580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 4.1580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9483 -3.8539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -3.6270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5683 -2.7800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4292 -2.2610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2023 -1.4140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3554 -1.6410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3554 -3.3730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5823 -4.2200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4292 -3.9930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -3.4370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -1.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2573 -2.6270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.1970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 -0.3420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 -0.3420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.1970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 29 1 0 0 0 0 2 17 2 0 0 0 0 3 30 2 0 0 0 0 4 14 1 0 0 0 0 4 18 2 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 5 42 1 0 0 0 0 6 26 1 0 0 0 0 6 30 1 0 0 0 0 6 58 1 0 0 0 0 7 23 3 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 8 31 1 0 0 0 0 9 11 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 12 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 13 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 16 19 1 0 0 0 0 16 20 1 0 0 0 0 16 21 1 0 0 0 0 16 22 1 0 0 0 0 19 24 2 0 0 0 0 19 25 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 24 27 1 0 0 0 0 24 52 1 0 0 0 0 25 28 2 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 M END $$$$