IBS-ZINC02300437 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 0.0760 1.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -0.6110 -2.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -0.3450 -2.5460 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 -0.5820 -3.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -1.0260 -4.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -1.0330 -3.5620 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -1.4220 -3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -1.3500 -5.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -1.7420 -6.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 -1.2230 -6.4740 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8940 -0.7920 -5.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9510 -0.6900 -6.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -0.4720 -4.5020 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0460 -0.0060 -3.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 -1.5590 -7.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 -3.0150 -8.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 -3.3980 -8.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9370 -4.7330 -8.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 -5.6870 -8.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -5.3030 -8.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -3.9670 -8.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3530 -7.3640 -8.4760 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -0.2350 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -0.2010 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -0.6950 -1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -2.4900 -3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 -1.2010 -4.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 -0.8650 -3.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 1.0790 -3.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9250 -0.4570 -4.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9980 -0.2940 -2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 -0.9450 -8.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -1.3690 -8.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3850 -2.6530 -8.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9740 -5.0320 -8.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -6.0470 -8.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -3.6670 -8.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 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 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 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 20 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 M END