IBS-ZINC02211004 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 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 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.0240 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1010 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 -2.6290 0.0350 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8240 -3.7080 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7550 -2.2360 1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1440 -2.8070 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7700 -3.1770 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0690 -3.6980 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6590 -3.8240 1.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0340 -3.4660 2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8050 -2.9680 2.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6880 -3.6180 3.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.9380 -4.1220 3.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4900 -4.4430 2.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6360 -4.2840 4.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0040 -3.9160 6.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6620 -4.0690 7.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9450 -4.5880 7.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5780 -4.9540 6.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9340 -4.8000 4.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7320 -5.2540 3.5090 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.0670 -3.0250 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 -3.5230 -2.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7820 -2.2210 -1.2080 C 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 -0.3430 -2.6010 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1800 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2260 -2.6110 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8150 -1.1500 1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5780 -3.9900 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2470 -3.3620 4.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0030 -3.5120 6.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1740 -3.7850 8.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4540 -4.7060 8.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5790 -5.3580 6.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0120 -1.1560 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2080 -2.4430 -2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 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 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 46 1 0 0 0 0 30 47 1 0 0 0 0 M END