IBS-ZINC02159308 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3850 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0030 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.6900 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 0.0130 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 1.4200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 2.0950 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7740 1.8490 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5260 0.7370 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 -0.3700 -0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 -1.2870 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2760 3.2700 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 3.7890 1.4240 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9480 3.1140 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9580 5.1640 1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2490 6.1460 1.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2960 5.3030 1.3600 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9120 6.6370 1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8290 6.7650 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8330 5.6100 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0820 4.2800 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1680 4.1240 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7590 5.7510 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3420 6.1980 -2.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0500 5.3800 -0.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6610 4.7270 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8920 3.9740 -0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3930 4.9640 -1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0810 5.5560 -1.9580 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7900 5.0280 -2.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2680 7.0220 -2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6090 7.8450 -1.6630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9080 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5510 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -1.7700 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 3.1750 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6050 0.7180 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2710 3.3040 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 3.8950 -0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1340 7.3990 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4960 6.7640 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2310 6.7290 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3660 7.7130 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4140 5.6320 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4810 4.2670 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7980 3.4580 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7720 4.0490 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5580 3.2260 1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9740 5.4730 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9600 4.0240 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6470 3.8260 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5990 3.0230 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0130 5.7420 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9380 4.4350 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 4.1350 2.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1660 7.4130 -3.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 3.8570 1.9820 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 4.4770 1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2500 8.3640 -3.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 56 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 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 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 28 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 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 30 55 1 0 0 0 0 54 56 1 0 0 0 0 55 58 1 0 0 0 0 56 57 1 0 0 0 0 M END