IBS-ZINC04025879 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 62 0 0 1 0 0 0 0 0999 V2000 -1.2700 1.9350 0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 0.4150 0.2660 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3320 0.0790 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -0.2530 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -0.0080 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 0.3840 -0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 0.6580 -1.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 0.0190 -1.2130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2290 -1.0660 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5330 0.5240 -1.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 0.0430 -3.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0140 -1.2920 -3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4680 -1.1870 -4.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0000 -2.5820 -4.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4930 -1.7530 -6.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0140 -3.8090 -5.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 0.8290 -4.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 1.8940 -4.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0930 0.3860 -5.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -0.2320 1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 1.0290 1.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 0.8050 2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0360 1.5310 2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9730 2.5840 1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3150 1.3130 3.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 2.2680 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 2.4080 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 2.2130 1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 0.1600 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -1.3260 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 0.5220 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 1.7350 -1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 0.2430 -2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 0.1530 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 1.6140 -1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 -1.7290 -4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9590 -1.9250 -2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0720 -0.7500 -3.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5230 -0.5540 -5.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -3.0180 -5.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 -3.2140 -3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9220 -2.2810 -6.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0920 -0.7480 -6.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5380 -1.6920 -6.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9910 -4.2970 -4.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4610 -4.4110 -5.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0470 -3.7040 -5.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 0.6640 -6.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 0.8690 -6.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 -0.6960 -5.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -1.0700 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 -0.4540 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 1.8660 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8930 1.2510 2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 0.0460 3.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5650 3.5050 1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9760 2.7720 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3330 2.2370 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1700 0.5170 3.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1100 1.0310 2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 2.2330 3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3970 -2.4800 -4.9010 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 62 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 62 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 16 62 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 2 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 M END