IFLAB-ZINC04128321 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -0.5610 1.5520 0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 0.1320 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -0.3710 0.4990 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2330 -1.8180 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -0.3060 2.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -0.1270 2.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -0.4460 2.6350 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 -0.4820 4.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 -1.1470 4.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6800 -1.1850 6.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 0.2430 6.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 0.9080 6.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 0.9460 4.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 0.4700 -0.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 1.6600 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 2.8760 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 3.6050 0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4210 4.6800 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 4.8240 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 3.5550 -1.4880 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 0.1500 -1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8300 0.3140 -1.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 -0.4000 -2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 -1.0120 -2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -1.5110 -3.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -1.4090 -4.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 -0.8240 -4.6380 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 -0.3180 -3.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -1.8540 -5.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 2.2090 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 1.9090 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.5480 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -0.5260 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 0.1350 -1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -1.8310 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -2.3740 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -2.2780 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 -0.5240 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -1.0520 4.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 -2.1640 4.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 -0.5780 4.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -1.7540 6.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6070 -1.6590 6.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 0.2160 7.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4700 0.8120 6.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 0.3390 6.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 1.9250 6.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1170 1.5150 4.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 1.4200 4.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 1.5460 1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 1.7790 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 3.3750 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 5.3520 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 5.6020 -1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -1.0830 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 -1.9820 -2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 0.1520 -3.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -0.7610 -5.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 14 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 52 1 0 0 0 0 18 19 2 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 29 2 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 28 57 1 0 0 0 0 M END