IFLAB-ZINC04279985 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 0 0 1 0 0 0 0 0999 V2000 0.4430 1.5900 -2.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 0.1730 -2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 0.1250 -0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -0.3480 0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -1.9400 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -2.6160 -2.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -4.0780 -2.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 -6.1350 -4.2680 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4120 -6.5510 -3.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -6.9220 -5.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 -6.9300 -4.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9150 -6.3620 -3.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -7.5680 -5.2080 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9660 -7.6760 -4.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0570 -7.8210 -3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2960 -7.9280 -2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4460 -7.8910 -3.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3580 -7.7460 -4.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1220 -7.6440 -5.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0010 -8.0250 -2.6250 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -6.2300 -4.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -5.2280 -5.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 2.1430 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 1.5390 -3.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 2.0960 -3.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 0.2230 -2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -0.3800 -3.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 -0.1500 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 1.2080 -0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -0.1540 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 0.1910 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 -1.4170 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -2.0600 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -2.4010 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -2.1010 -3.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 -2.5700 -3.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -4.5930 -2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 -4.1240 -2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -7.9460 -5.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -6.4520 -6.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 -7.9520 -6.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1600 -7.8500 -2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3670 -8.0410 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2570 -7.7160 -5.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0540 -7.5360 -6.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -0.5100 -1.7460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -4.7260 -4.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 -4.2290 -5.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -7.4290 -4.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 -7.4400 -5.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 46 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 46 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 8 47 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 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 41 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 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 47 48 1 0 0 0 0 49 50 1 0 0 0 0 M END