IBS-ZINC02404710 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.2950 1.3940 1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -0.0330 1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -0.7000 1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -2.0870 0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 -2.6720 0.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -2.7230 0.2190 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -2.1110 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -2.7130 -0.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 -0.7200 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -0.0870 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 1.3260 0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 2.0100 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 3.3700 -0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5910 4.0810 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 3.4090 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 2.0480 0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6460 5.4320 -0.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 6.1000 0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 7.5860 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 8.0920 -0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5330 9.4550 -0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 10.3130 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2760 9.8080 0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3560 8.4440 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5040 7.8080 2.2940 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -4.1100 -0.2180 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5620 -4.4640 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -4.9970 0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -6.3540 0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 -5.8400 -0.9570 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -5.6800 -0.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -6.6680 -2.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -4.1950 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 -0.0360 1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 0.4900 2.3990 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 1.5890 2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 2.0680 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 1.5580 1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3220 -0.6720 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 1.4600 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 3.8970 -1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1440 3.9670 1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 1.5290 1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 5.7480 0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3870 5.8860 1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 7.4220 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 9.8500 -1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 11.3780 -0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9260 10.4790 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -4.5330 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -5.1470 1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -6.9040 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -6.9480 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -4.1140 -2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -3.4100 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 33 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 2 0 0 0 0 30 32 2 0 0 0 0 30 33 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 34 35 3 0 0 0 0 M END