BC53VR -OEChem-04022108442D 43 46 0 1 0 0 0 0 0999 V2000 3.3660 -5.4330 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.0670 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -3.7010 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.7210 1.1883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.4330 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4103 -1.3717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 0.2377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 0.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1593 -1.9386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9477 -1.6810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4548 -0.9817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4548 -0.1523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -2.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 3.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -4.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.1870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 2 28 1 0 0 0 0 3 28 1 0 0 0 0 4 14 2 0 0 0 0 5 16 2 0 0 0 0 6 10 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 11 1 0 0 0 0 7 16 1 0 0 0 0 7 35 1 0 0 0 0 8 29 3 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 10 12 1 0 0 0 0 11 15 1 6 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 17 20 1 0 0 0 0 17 21 2 0 0 0 0 18 23 1 0 0 0 0 18 36 1 0 0 0 0 19 24 2 0 0 0 0 19 37 1 0 0 0 0 20 22 2 0 0 0 0 20 38 1 0 0 0 0 21 25 1 0 0 0 0 21 39 1 0 0 0 0 22 27 1 0 0 0 0 22 28 1 0 0 0 0 23 26 2 0 0 0 0 23 40 1 0 0 0 0 24 26 1 0 0 0 0 24 41 1 0 0 0 0 25 27 2 0 0 0 0 25 42 1 0 0 0 0 26 29 1 0 0 0 0 27 43 1 0 0 0 0 M END $$$$