IFLAB-ZINC00723879 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 -0.0760 1.2400 1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -0.2640 1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 -0.6610 0.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 -1.9800 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -2.7800 0.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9450 -2.4340 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1580 -3.7310 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3880 -4.1670 -0.5180 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 -3.3700 -0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9440 -4.0470 -1.1450 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.4020 -2.0510 -0.3590 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 -1.4810 0.0860 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8480 -0.6890 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 -0.8520 1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8570 -1.6010 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0520 -1.0290 3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7170 0.2990 3.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1850 1.0540 2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 0.4720 1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 2.3570 3.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4090 3.0970 1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9080 0.8640 5.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 0.0300 6.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5470 -5.5880 -0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 -4.7130 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 1.5280 1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 1.7840 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 1.4770 2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -0.4900 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -0.8060 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1900 -1.4920 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1190 -2.6360 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4650 -1.6160 4.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5710 1.0540 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1230 4.1030 2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 2.5960 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2130 3.1580 1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7980 -0.8190 6.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5590 0.6030 7.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4390 -0.3290 5.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7370 -6.1480 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3860 -5.7140 -1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 -5.9580 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 -4.7090 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 -5.7120 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -4.4280 -0.7240 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 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 14 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 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 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 34 1 0 0 0 0 20 21 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 M END