IBS-ZINC05310381 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 0.6800 0.0770 1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -1.2470 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 -2.3440 1.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -1.1010 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 -0.8650 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -0.7300 1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0800 -0.8320 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 -1.0670 -1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 -1.1970 -1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -1.4300 -2.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -2.0280 -3.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -2.2990 -3.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -2.3600 -4.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -3.1500 -5.7180 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -3.4210 -6.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -3.0950 -6.6480 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -4.3420 -8.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 -3.4440 -7.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 -4.0290 -8.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 -4.0070 -8.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -4.4850 -9.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9020 -4.3430 -10.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -3.7580 -9.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -3.3320 -8.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 -4.8960 -11.6070 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -0.0290 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 0.8590 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 0.3460 1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -1.5160 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -2.0760 2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -3.2880 1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -2.4500 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -0.7860 2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2480 -0.5460 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1410 -0.7260 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6190 -1.1470 -2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -1.1610 -2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -1.4440 -4.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -3.0400 -3.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -4.9380 -10.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7660 -3.6490 -9.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 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 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 24 2 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 M END