IFLAB-ZINC04120560 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0300 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 2.1860 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1740 2.5050 -1.7300 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6680 3.3940 -1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1220 3.6520 -0.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3800 4.4040 -0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6150 4.5620 -1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4580 3.8710 -2.4690 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2150 3.7320 -3.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9870 4.1970 -4.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 3.0000 -4.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 2.9860 -5.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5420 1.9510 -6.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5080 1.9370 -7.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8770 2.9600 -8.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 3.9960 -7.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 4.0050 -6.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 2.9470 -9.8750 F 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -0.6290 -0.0350 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.7590 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 3.1670 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 3.1340 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 1.6060 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2760 5.3800 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1950 3.8420 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6240 5.6150 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5440 4.0750 -2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0060 1.9760 -3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 3.5050 -3.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 1.1530 -5.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9740 1.1280 -8.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 4.7940 -8.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 4.8120 -5.9000 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 M END