IFLAB-ZINC04061785 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 1.5920 -2.8530 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -1.7370 2.1780 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4600 -1.5280 3.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -0.4730 1.3170 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3470 -0.7030 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 0.5900 2.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 0.9760 1.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 1.9720 2.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 2.3940 3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 1.5060 3.4290 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -0.1930 2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 0.3970 1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 -0.2460 0.7640 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1550 -0.0400 -0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 -0.6300 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3150 0.2170 0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0340 -0.2690 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3140 0.1880 -0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8830 1.1330 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1660 1.6190 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8830 1.1670 1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1450 1.5830 -0.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6680 2.5550 0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -2.1570 2.5280 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 -2.8410 4.0060 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 -3.1370 3.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -3.8760 4.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -1.5160 5.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6650 -2.6640 1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 -3.8100 1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -2.8820 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 0.5440 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 2.3760 2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 3.1620 4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 -1.2600 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 0.3020 3.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 1.4690 1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0940 0.2200 2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0620 1.0270 -0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 -0.5360 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 -0.4530 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 -1.7030 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 -1.0050 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8730 -0.1900 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6100 2.3540 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3230 1.5500 2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6790 2.8270 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0340 3.4420 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6900 2.1380 1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 -2.0360 1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -0.6690 4.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 -1.8820 6.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -1.2010 5.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 0.0130 1.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 24 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 54 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 54 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 M END