IBS-ZINC02402106 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.2830 1.6080 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 0.0820 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -0.4360 -1.4540 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5130 -1.9680 -1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -2.4530 -2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -1.6500 -3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 -2.4880 -4.2820 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 -3.9740 -4.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -3.7920 -3.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -4.8830 -2.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -6.0170 -3.4030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -6.1400 -4.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 -5.1540 -4.6760 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 -7.7000 -5.1180 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -8.6340 -4.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -10.0630 -4.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -10.8530 -4.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -12.2610 -4.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 -13.2460 -4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -14.5370 -4.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -14.8430 -5.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 -13.8580 -6.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -12.5680 -5.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -4.7730 -1.7850 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5920 -0.2010 -2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 0.0160 -1.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 0.0880 -2.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 2.0290 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 1.9070 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 1.9780 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -0.2160 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -0.3380 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -2.3430 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -2.3200 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -8.6590 -3.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -8.1540 -4.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -10.0390 -5.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 -10.5440 -4.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -10.8780 -3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -10.3730 -4.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -13.0060 -3.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -15.3060 -4.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -15.8510 -6.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 -14.0970 -7.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -11.7990 -6.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -3.9760 -1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -5.4920 -1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6530 0.0060 -2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 0.4530 -3.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 1.1780 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -0.2810 -3.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -0.2590 -2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 2 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 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M END