IBS-ZINC02140772 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 67 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 3 0 0 0 0 0 0 0 0 0 0.8500 -0.4790 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 0.1600 2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 -0.2880 2.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -0.0050 1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 0.6470 1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -0.5050 0.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4230 -1.5950 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 -0.0450 -0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -0.6010 -2.2520 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6010 -1.6840 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 0.0840 -2.4160 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4230 1.1600 -2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -0.4720 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.2070 -3.7960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 0.0370 -4.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 0.3660 -5.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3600 -0.1890 -3.5720 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9270 0.7340 -3.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 -1.3090 -4.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 -1.9560 -5.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3080 -1.4450 -7.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2540 -0.3700 -6.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5680 0.7430 -6.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9110 0.2320 -4.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9270 0.0730 -8.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8680 1.0900 -7.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5320 1.5250 -9.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2590 0.9510 -10.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3220 -0.0610 -10.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6510 -0.4980 -9.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 1.9040 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 1.8850 -0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 1.8790 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -1.5640 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -0.1840 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -0.1440 3.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 1.2450 2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -1.3570 2.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 0.2610 3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4410 0.9960 2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6670 0.8370 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -0.4400 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 1.0440 -1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 -0.0680 -1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -1.5610 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 -2.1760 -4.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9830 -1.5860 -3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4150 -2.3650 -5.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 -2.7330 -6.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 -1.0600 -7.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8410 -2.2620 -7.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8040 1.1520 -6.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2920 1.5200 -6.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3780 1.0490 -4.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6780 -0.1520 -4.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0820 1.5380 -7.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2640 2.3150 -9.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7790 1.2940 -11.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1110 -0.5070 -11.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 -1.2850 -9.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 -0.8430 -5.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 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 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 63 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 22 63 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 26 63 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 30 31 2 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 31 61 1 0 0 0 0 32 62 1 0 0 0 0 M END