IFLAB-ZINC04033717 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -0.6750 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 0.1840 2.2850 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -2.0230 0.9960 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -2.7530 2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -4.2570 1.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -5.0080 2.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -5.4510 4.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -6.1760 5.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 -6.6580 6.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 -7.3400 7.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -7.5490 7.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8270 -7.0810 5.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 -6.3900 4.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -5.9140 3.8840 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 -6.0620 3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 -5.2530 2.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 -4.8500 1.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1680 -7.2940 5.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7790 -8.0090 6.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -6.4550 6.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -6.9750 7.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -0.4910 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -2.5100 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -2.4750 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -2.5010 3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -4.5350 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -4.5090 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -5.2700 4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -7.7120 8.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -8.0840 7.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8480 -8.1100 6.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6260 -7.4650 7.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3300 -8.9990 7.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -6.7440 7.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -8.0560 7.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 -6.5220 8.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M END