IBS-ZINC02196635 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 67 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.9920 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -2.6020 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -1.8350 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4550 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 0.1610 -2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -2.5030 -4.3820 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7610 -3.5320 -4.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -2.4770 -5.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -2.8440 -6.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -2.3500 -7.4000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -2.4580 -8.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 -1.7190 -7.6370 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -1.7480 -6.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 -1.3280 -6.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 -0.6810 -6.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -1.7620 -4.7630 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8750 -1.5310 -3.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8790 -2.6720 -4.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0750 -2.4340 -3.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0910 -2.9340 -1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1860 -2.7190 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2720 -2.0010 -1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2560 -1.4970 -2.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1580 -1.7210 -3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3200 -0.7900 -3.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2340 -0.3040 -4.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3500 -1.7880 -0.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2960 -2.3340 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -3.6280 -5.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -4.8950 -5.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 -5.6210 -5.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 -5.0980 -4.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 -3.8440 -3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -3.1050 -4.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -1.8740 -3.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -2.5910 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -3.6800 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 0.1420 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 1.2380 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3460 -0.5860 -4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 -1.4910 -2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4080 -3.6160 -3.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1980 -2.7110 -5.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2450 -3.4940 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1960 -3.1110 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1450 -1.3350 -4.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1450 0.2400 -4.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1150 -1.1440 -5.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3760 0.3630 -4.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4460 -1.9090 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1840 -3.4160 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2170 -2.0920 1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -5.3060 -6.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 -6.6020 -5.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4490 -5.6720 -3.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8750 -3.4410 -2.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -1.1530 -4.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 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 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 59 1 0 0 0 0 34 35 1 0 0 0 0 34 60 1 0 0 0 0 35 36 2 0 0 0 0 35 61 1 0 0 0 0 36 37 1 0 0 0 0 36 62 1 0 0 0 0 37 38 1 0 0 0 0 38 63 1 0 0 0 0 M END