BNCD53 -OEChem-04022106392D 38 39 0 1 0 0 0 0 0999 V2000 3.3660 -4.9524 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.5864 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -3.2204 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.9136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.9136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.5864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.4136 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.9136 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1752 3.3833 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 4.0014 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9641 4.9524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 4.9524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6551 4.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.4136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2242 3.6924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3701 3.3890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5706 5.0813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8993 5.5690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0289 5.5690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3576 5.0813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0887 4.2536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3451 3.4644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 2.4962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 1.8059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.6036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.7764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.7764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.3964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.3964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 24 1 0 0 0 0 3 24 1 0 0 0 0 4 14 2 0 0 0 0 5 17 2 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 10 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 8 15 1 0 0 0 0 8 17 1 0 0 0 0 8 34 1 0 0 0 0 9 16 3 0 0 0 0 10 11 1 0 0 0 0 10 16 1 1 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 19 35 1 0 0 0 0 20 22 2 0 0 0 0 20 36 1 0 0 0 0 21 23 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 M END $$$$