NCID-ZINC04538853 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 55 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.6650 -0.4960 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -0.7210 2.1740 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1950 -0.1260 3.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 -2.2390 2.4600 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1390 -2.8130 1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 -2.4500 2.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5830 -1.6380 1.8290 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4990 -1.2860 2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -0.4180 1.4560 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1260 0.5440 1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -0.5190 0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 -2.4160 0.6310 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 -3.5120 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -3.9540 -0.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 -3.1710 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 -2.1780 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9230 -1.2760 -0.3030 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8000 -1.3110 -1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7630 -2.2250 -2.2370 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8210 -3.1640 -2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7830 -4.3810 -3.5270 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.2100 -3.8530 -4.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3780 -4.7760 -5.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1650 -5.9060 -5.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3190 -6.7530 -6.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6850 -6.4690 -7.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8980 -5.3380 -7.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7480 -4.4900 -6.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -2.6130 3.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -4.0310 3.8390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -0.5140 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -3.9490 0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5780 -0.5630 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1080 -3.8860 -3.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0510 -2.8350 -4.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6600 -6.1280 -4.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9340 -7.6360 -6.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8050 -7.1310 -8.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4030 -5.1170 -8.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1360 -3.6040 -6.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 -2.2740 3.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.1350 4.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -4.3400 4.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -0.1320 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -1.6030 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -0.1680 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 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 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 28 29 2 0 0 0 0 28 43 1 0 0 0 0 29 30 1 0 0 0 0 29 44 1 0 0 0 0 30 45 1 0 0 0 0 31 32 1 0 0 0 0 31 46 1 0 0 0 0 31 47 1 0 0 0 0 32 48 1 0 0 0 0 33 49 1 0 0 0 0 33 50 1 0 0 0 0 33 51 1 0 0 0 0 M END