IBS-ZINC06659780 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 -1.2540 1.1890 0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -0.1550 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.7060 1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -1.9450 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -2.6250 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -2.0750 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -0.8430 -1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -0.1590 -2.5120 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.0150 2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -0.6950 3.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -1.9070 3.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 0.0520 4.8820 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7070 0.6910 5.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -0.9460 6.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -1.5690 6.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 -2.7300 6.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 -0.8680 5.8290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 0.4200 5.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 0.8720 4.8760 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 2.1840 4.4500 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 2.4650 4.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 1.3810 5.1940 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4980 3.7600 4.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8550 3.9350 4.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4610 5.1420 4.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7250 6.1760 3.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3780 6.0080 3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 4.8070 3.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.9740 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 1.2310 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 1.3330 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -2.3760 1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -3.5890 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6080 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 0.9540 2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -1.7300 5.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.4280 6.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 -1.2500 5.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4310 3.1280 5.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5130 5.2780 4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2030 7.1180 3.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 6.8180 3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 4.6780 3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 9 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 22 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 27 2 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 M END