IBS-ZINC02150368 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 72 0 0 1 0 0 0 0 0999 V2000 -0.4170 1.9930 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 0.5140 -0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 0.0470 0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -1.3090 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -2.1980 -0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -1.7310 -1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -0.3750 -1.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -3.9270 -0.1000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -4.4980 -1.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -4.0570 1.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 -4.5340 0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 -4.5150 -1.1120 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0520 -3.7170 -1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -5.8390 -1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2910 -5.8800 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -7.0940 -3.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -8.2690 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 -8.2280 -1.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 -7.0130 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 -4.2740 -0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9870 -4.1320 0.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7640 -4.2160 -1.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0230 -4.1040 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5980 -2.8440 -0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8630 -2.7170 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5840 -3.8560 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9490 -3.7480 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6040 -4.9190 0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9550 -6.1510 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5380 -7.1770 0.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7100 -6.2300 0.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0100 -5.1310 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7260 -5.2440 -0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0970 -6.6030 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5990 -2.4330 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9170 -1.9730 1.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5230 -0.7460 2.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8170 0.0340 1.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5030 -0.4200 -0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8920 -1.6430 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4140 1.2430 1.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.6890 1.9930 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 2.4310 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 2.1520 -2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 2.4660 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 0.7420 1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -1.6740 1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -2.4260 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -0.0110 -2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -4.9010 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 -4.9620 -3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2370 -7.1260 -4.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -9.2180 -3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -9.1450 -1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1790 -6.9810 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0410 -1.9640 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3050 -1.7380 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6060 -4.8850 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5630 -6.8720 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8740 -7.3410 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3980 -6.5790 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6890 -2.5790 2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7690 -0.3890 3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7340 0.1890 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6430 -1.9940 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1650 2.9360 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7560 2.1940 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3550 1.4210 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 47 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 48 1 0 0 0 0 7 49 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 52 1 0 0 0 0 17 18 2 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 33 2 0 0 0 0 24 25 2 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 26 32 2 0 0 0 0 27 28 2 0 0 0 0 27 35 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 59 1 0 0 0 0 34 60 1 0 0 0 0 34 61 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 36 62 1 0 0 0 0 37 38 1 0 0 0 0 37 63 1 0 0 0 0 38 39 2 0 0 0 0 38 41 1 0 0 0 0 39 40 1 0 0 0 0 39 64 1 0 0 0 0 40 65 1 0 0 0 0 41 42 1 0 0 0 0 42 66 1 0 0 0 0 42 67 1 0 0 0 0 42 68 1 0 0 0 0 M END