IFLAB-ZINC04280008 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 37 0 0 1 0 0 0 0 0999 V2000 -0.2800 1.0580 -0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -0.4560 -0.6770 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3450 -0.9030 -1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 -0.7530 0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -2.5280 2.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1650 -1.8300 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -3.9550 2.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -4.0320 2.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -3.0440 2.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -5.2000 3.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 -5.2480 3.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9770 -6.3860 3.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 -6.4310 3.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8440 -5.3460 4.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 -4.2110 4.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 -4.1620 4.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7850 -2.8510 5.5250 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -2.4200 1.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -2.1050 0.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -1.0050 -0.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 1.4780 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 1.2710 -1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 1.5060 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -0.2590 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -0.3830 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -4.6430 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -4.2270 3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -6.0070 3.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 -7.2340 2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8840 -7.3150 3.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8710 -5.3840 4.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 -3.2780 4.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 -0.6510 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -2.2040 0.7600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -2.6900 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 -2.6730 2.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 -2.5910 2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 20 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 18 1 0 0 0 0 5 34 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 32 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 20 33 1 0 0 0 0 34 35 1 0 0 0 0 36 37 1 0 0 0 0 M END