BP3OQ7 -OEChem-04022108322D 51 53 0 0 0 0 0 0 0999 V2000 8.9282 -4.0864 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.0864 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -1.7204 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -3.4524 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.4282 -3.2204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4282 -4.9524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5211 4.0014 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.4136 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0864 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5864 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.4136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.4136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1391 4.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8301 4.9524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 4.9524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 3.6924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -4.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -4.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 1.8310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9407 2.5213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 2.4962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 1.8059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 0.3310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 1.0212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7288 3.8098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 0.7236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4657 5.4540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1946 5.4540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3785 4.2820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9804 3.5008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7616 3.1027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.7764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.4664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -3.8964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -2.2764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -4.7064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4842 -5.1233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -4.8964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 -4.0495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 1 29 1 0 0 0 0 2 30 1 0 0 0 0 3 30 1 0 0 0 0 4 30 1 0 0 0 0 7 13 1 0 0 0 0 7 16 1 0 0 0 0 7 19 1 0 0 0 0 8 14 1 0 0 0 0 8 18 1 0 0 0 0 8 38 1 0 0 0 0 9 18 2 0 0 0 0 9 21 1 0 0 0 0 10 21 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 14 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 15 2 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 17 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 18 23 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 20 26 1 0 0 0 0 22 27 2 0 0 0 0 22 28 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 30 1 0 0 0 0 25 27 1 0 0 0 0 25 45 1 0 0 0 0 26 28 2 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 M END $$$$