IBS-ZINC02454394 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.1780 1.3920 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -0.1150 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -0.8220 0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 -2.2040 0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -2.8780 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -2.1710 -1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 -0.7890 -1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -4.3850 -0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -5.0330 0.1880 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -6.7620 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -7.3260 -0.4690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -8.6060 -0.4360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -8.9380 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 -7.7680 0.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 -7.6280 1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5200 -7.4060 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5820 -8.1700 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 -10.3100 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -11.3410 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -12.6190 0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9760 -12.8810 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8550 -11.8630 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3880 -10.5790 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 -14.4930 0.9350 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 1.7810 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 1.7540 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 1.7290 0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.2950 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -2.7570 1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -2.6980 -2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -0.2360 -2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -4.7220 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -4.7460 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7340 -8.5370 1.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 -6.7780 1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3810 -6.6160 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6970 -8.9910 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3430 -7.9800 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -11.1380 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -13.4180 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 -12.0730 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0750 -9.7850 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 M END