IBS-ZINC02128415 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -0.3310 1.3430 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -0.1720 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -0.6460 0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -2.1730 0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -2.6840 2.0900 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0820 -2.3490 2.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -4.2220 2.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -4.9030 1.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -4.7510 2.6490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -6.1840 2.7720 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3570 -6.6560 1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -6.8290 3.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -6.3990 3.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -5.3160 3.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 -2.1890 2.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8210 -2.2460 1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0360 -1.8060 1.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5680 -1.2480 2.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8790 -0.7620 2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4490 -0.2110 3.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7120 -0.1400 4.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 -0.6200 4.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8420 -1.1710 3.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4610 -1.6800 3.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 -1.6270 4.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 1.8180 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 1.6590 -1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 1.7100 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -0.6160 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -0.5090 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -0.1870 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -0.3060 1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 -2.6100 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -2.5200 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -4.1710 2.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -6.7150 3.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -6.3710 4.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -7.9010 3.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 -2.7120 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4580 -0.8180 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4700 0.1620 3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1560 0.2880 5.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8310 -0.5620 5.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -7.5920 3.1200 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 44 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 M CHG 1 44 -1 M END