IFLAB-ZINC04062368 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 0 0 0 0 0999 V2000 -1.9890 1.6140 1.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 1.0380 1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 0.6060 1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 0.1170 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 -0.4500 0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -0.8260 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -0.6450 -1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -0.0860 -1.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 0.2830 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 0.8430 -0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 1.0750 -0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 0.6100 3.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -0.0130 3.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 1.3650 4.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 2.5780 4.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 0.6000 5.3840 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 1.1120 6.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 2.2730 7.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 4.5100 6.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 5.7250 5.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 6.3600 5.8230 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 5.4830 5.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 4.2900 6.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 7.7310 5.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 8.2990 6.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 9.6850 6.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 10.5410 6.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 10.0100 5.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 8.6240 5.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 2.6620 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 1.5740 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 1.0560 2.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -0.5970 1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0280 -1.2630 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -0.9430 -2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 0.0530 -2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -0.3770 5.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 1.3920 6.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 0.2670 7.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 2.4660 8.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 2.0330 7.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 3.9510 6.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 4.8110 7.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 6.4090 6.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 5.4110 4.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 5.9980 5.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 5.1160 4.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 4.6100 7.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 3.5800 6.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 7.6700 6.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0690 10.0920 7.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 11.6170 6.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 10.6730 5.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 8.2510 5.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 3.5640 6.4720 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3430 3.3020 5.4750 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 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END