IBS-ZINC02115425 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.2690 -0.7390 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -0.0630 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 -0.7730 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 -2.1670 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 -2.8510 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -2.1460 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -2.7940 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 -2.1270 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -2.7540 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -0.7180 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -0.0050 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 0.1330 -1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3380 0.8460 -1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8140 1.2080 -0.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9970 1.0810 -2.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2880 1.7740 -2.4980 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8380 1.4890 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0840 1.3920 -3.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4440 1.1700 -3.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1750 0.8200 -4.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5450 0.6920 -5.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1840 0.9150 -6.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4550 1.2700 -4.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0580 3.2640 -2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9320 3.7010 -2.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8060 -2.8590 -0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1800 0.0660 -0.0470 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 1.0170 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -3.9310 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 -0.5780 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 0.9850 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 0.7060 -1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 -0.8570 -1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 0.7920 -3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9360 1.2700 -2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2380 0.6460 -4.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1150 0.4180 -6.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6920 0.8150 -7.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3930 1.4470 -5.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1530 -3.0640 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1040 4.1040 -2.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9070 5.0510 -2.4720 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 12 2 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 28 45 1 0 0 0 0 46 47 1 0 0 0 0 M END