IBS-ZINC04026111 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3840 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -0.6900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0120 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 1.4190 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 1.8480 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 0.7360 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -0.3710 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 -1.2890 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 3.2690 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 3.7850 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 5.1660 1.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 6.3560 1.3270 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1700 6.1940 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 7.4910 0.8440 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6110 8.4910 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 7.3190 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3520 7.6880 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4310 7.7980 -0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4720 7.6080 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2130 7.0150 1.5370 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1380 7.3090 2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1310 5.5190 1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0720 4.7550 1.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 6.6740 2.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.7700 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 3.1740 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6040 0.7170 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 3.3030 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 3.8950 -0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 3.7510 1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 3.1590 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 6.2780 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2580 7.9460 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4240 7.8770 -2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3520 8.0390 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3130 6.9590 1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6300 8.5770 1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 5.9780 2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 26 42 1 0 0 0 0 M END