IBS-ZINC02357219 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 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 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.0990 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5460 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -1.9280 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -2.6690 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -2.0280 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -2.7560 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -4.1790 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9870 -2.6270 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4530 -2.8560 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7510 -3.5350 -1.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0600 -2.8720 -1.3770 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.1770 -2.2520 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0900 -3.9690 -1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4050 -4.3080 -1.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4570 -5.6730 -1.3710 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2720 -6.1990 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2670 -6.1570 -1.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3740 -5.1870 -1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9350 -4.8660 -1.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0410 -5.6900 -1.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5570 -3.3800 -1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4120 -3.3440 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4840 -2.4760 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7160 -1.6410 -1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8760 -1.6680 -2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7910 -2.5290 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9600 -2.5530 -3.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1970 -2.0280 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8010 -0.7870 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9270 -0.0120 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4480 -0.4800 2.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8440 -1.7220 2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7240 -2.4980 1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6060 0.4930 3.5700 Cl 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 -2.3340 1.1790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -3.7480 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -4.6370 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -4.5010 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -4.4840 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 -3.5870 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 -2.0100 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5490 -1.8960 -1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 -3.4730 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2350 -3.9950 0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1460 -2.4490 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5580 -0.9650 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0620 -1.0140 -3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2250 -3.1790 -4.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1740 -0.4220 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3980 0.9580 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4700 -2.0880 3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2560 -3.4700 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 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 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 31 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 56 1 0 0 0 0 33 34 1 0 0 0 0 33 57 1 0 0 0 0 34 35 2 0 0 0 0 34 37 1 0 0 0 0 35 36 1 0 0 0 0 35 58 1 0 0 0 0 36 59 1 0 0 0 0 M END