IBS-ZINC04084220 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 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 0 0 0 0 0 0 0 0 0 0 -5.4120 -2.8710 1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7060 -2.5090 2.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5820 -3.4900 1.7130 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4540 -3.9380 0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5540 -5.4670 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7940 -5.9150 2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5540 -5.1490 3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9040 -5.9330 4.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8650 -5.6650 5.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2820 -6.6670 6.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7240 -7.8910 6.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7750 -8.1820 4.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3570 -7.1840 3.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2780 -7.1360 2.4660 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5270 -7.8570 1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0200 -3.7420 3.0970 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 -5.7220 -2.0080 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 -3.5830 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4470 -3.5050 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0330 -3.6200 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3830 -5.7910 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6240 -5.9010 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5210 -4.7150 6.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2650 -6.4970 7.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0400 -8.6430 6.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1220 -9.1400 4.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1760 -3.6380 3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8070 -3.0390 3.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 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 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 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 25 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END