IFLAB-ZINC04568700 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 0.1380 1.0070 -0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -0.2720 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 -0.5180 -0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 0.5260 -0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 1.7980 -0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 2.0420 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 3.0770 -0.0610 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -1.8520 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 -1.9690 -1.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -2.9530 -0.8320 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -4.3260 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 -4.8260 -0.7580 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6750 -4.4000 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 -6.3410 -0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0170 -7.2110 -1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 -8.6010 -1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8460 -9.1000 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 -8.2720 0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3280 -6.8990 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0870 -8.9610 1.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 -10.3210 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0650 -10.4150 -0.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 -4.7640 -3.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 -3.9290 -3.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0750 -3.9230 -3.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9520 -3.3400 -1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9760 -4.1380 -0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 1.2000 -0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -1.0470 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 0.3510 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 3.0350 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -2.8210 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -4.9470 -0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 -4.4010 -2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -6.8190 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6780 -9.2670 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8010 -6.2820 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8250 -10.8010 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3390 -10.8570 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 -4.7330 -3.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -5.7960 -2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9810 -4.3620 -4.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4730 -2.8970 -3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9440 -3.3470 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6380 -2.2940 -1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3220 -5.1680 -0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8350 -3.6580 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 -4.2020 -1.6260 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3150 -3.1990 -1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 48 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END