IBS-ZINC02313340 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -0.9400 -1.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 -2.0530 -2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4070 -1.9150 -3.3460 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9850 -0.7080 -3.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 -0.0570 -2.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3200 1.2430 -2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1890 1.8380 -1.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9590 1.8180 -3.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3190 2.7140 -3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1000 1.1420 -4.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6360 -0.0750 -4.4540 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7530 1.7500 -5.3360 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9160 1.0440 -6.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6720 1.9380 -7.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8430 1.2010 -8.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5990 2.0940 -9.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7690 1.3570 -11.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5140 2.2370 -12.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8710 3.3410 -11.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 -2.9300 -1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1060 2.6480 -5.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4800 0.1260 -6.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9350 0.8010 -7.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1080 2.8560 -7.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6520 2.1820 -7.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4060 0.2820 -8.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8620 0.9570 -9.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0350 3.0130 -10.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5790 2.3380 -9.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3330 0.4380 -11.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7890 1.1140 -11.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7800 1.7950 -13.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2600 2.3950 -14.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 46 47 1 0 0 0 0 M END