BKZ3I2 -OEChem-04022107142D 51 54 0 1 0 0 0 0 0999 V2000 2.0000 -2.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5622 -1.0670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 1.4330 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7320 0.5670 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2320 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 3.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8301 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6962 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6962 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5622 1.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5622 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4282 1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4282 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4282 -1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6962 -1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0716 2.0319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5531 0.3470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1244 2.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6494 1.2210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 0.8130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5611 3.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 4.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3671 3.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -3.4330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 -3.4330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1592 0.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5622 2.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9651 1.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9651 0.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1182 -2.1039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9651 -1.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7382 -1.0300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3862 -1.0300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1592 -1.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0062 -2.1039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 10 1 0 0 0 0 2 17 2 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 3 20 1 0 0 0 0 4 17 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 23 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 1 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 29 1 6 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 11 1 0 0 0 0 9 12 2 0 0 0 0 10 13 2 0 0 0 0 11 14 2 0 0 0 0 11 32 1 0 0 0 0 12 15 1 0 0 0 0 12 33 1 0 0 0 0 13 16 1 0 0 0 0 13 34 1 0 0 0 0 14 18 1 0 0 0 0 14 19 1 0 0 0 0 15 18 2 0 0 0 0 15 35 1 0 0 0 0 18 36 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 23 1 0 0 0 0 21 42 1 0 0 0 0 22 24 2 0 0 0 0 22 43 1 0 0 0 0 23 25 2 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 M END $$$$