IBS-ZINC05206899 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -1.6880 1.5080 0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 0.0690 0.4590 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6100 0.0180 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 -0.3720 1.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -1.8120 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -2.8300 1.1920 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5030 -4.1950 0.8010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9850 -4.9400 1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -4.3470 0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -3.3330 1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -2.0960 1.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 -3.5890 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -5.6610 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4720 -6.5410 1.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -5.8970 -0.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 -7.1150 -0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 -7.3100 -1.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -8.5240 -2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -9.5060 -1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -9.2440 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -8.0750 0.2280 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -4.4590 -0.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -3.7940 -1.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 -4.0340 -2.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -4.9450 -3.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -5.6110 -2.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -5.3710 -0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -5.1830 -4.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -2.2780 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -2.9530 -0.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 -0.8500 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 2.1640 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 1.8240 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 1.5600 1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 0.2660 1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -0.3030 2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -2.9390 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -3.3660 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -2.9510 2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4330 -4.6350 1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -5.2190 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 -6.5230 -2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8710 -8.7040 -2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 -10.4650 -1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2180 -10.0060 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -3.0850 -1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -3.5140 -3.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 -6.3200 -2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 -5.8930 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 -5.9000 -4.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0530 -0.7740 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0050 -0.5550 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 11 2 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END