IFLAB-ZINC04371088 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0820 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7700 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0690 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.0750 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1290 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -4.7840 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -6.3000 1.0400 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9400 -6.5680 0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -6.9990 2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -8.4430 2.1840 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 -9.1440 2.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 -8.7850 1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 -7.6210 2.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8620 -9.7420 1.7580 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 -9.4980 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5080 -11.0300 1.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3730 -11.8660 1.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -11.4170 1.6450 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -10.4790 1.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -10.5540 1.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -9.3560 2.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 -9.0710 2.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9460 -10.1500 2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3480 -9.5680 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6540 -8.7010 1.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 -12.8300 1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -6.7120 0.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6250 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.6030 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.2720 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5160 -3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0190 -2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -4.4820 1.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -4.5070 1.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -6.6190 2.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 -6.8040 3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 -8.1570 2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 -10.6370 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 -10.8780 2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0760 -10.3790 2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3880 -9.0050 3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5300 -8.2950 1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -13.4120 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -13.1860 2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -12.9440 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -6.5050 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 23 2 0 0 0 0 16 17 2 0 0 0 0 16 18 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 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 30 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 M END