IBS-ZINC05324398 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 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 0.0230 -0.7800 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.1710 0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.4080 1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -4.5590 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.5080 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -3.2990 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1140 -0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7840 -1.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.4480 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.3110 2.5290 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7210 1.0280 2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 1.4470 2.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 2.7700 2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 3.6650 3.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 3.2470 3.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 1.9170 3.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 1.2620 3.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -0.0400 3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -0.8460 3.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6510 1.9190 3.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 2.4580 2.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4040 1.7890 2.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0080 2.4900 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5480 3.7290 0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2870 4.0680 1.9970 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9730 3.3030 2.2290 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -1.2760 3.3680 O 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 0.0710 -3.4550 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -5.5150 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -5.4260 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -3.2700 -2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 0.7450 1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 4.6960 3.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 3.9510 3.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 1.1970 4.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 2.7390 4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 0.7770 2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7920 2.0670 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8980 4.4200 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -1.0260 4.3010 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 1 0 0 0 0 12 20 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 38 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 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 29 45 1 0 0 0 0 M END