OTAVA-ZINC04226431 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0080 1.5370 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 0.0410 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.6110 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.0090 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -2.7180 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -4.1330 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -4.7880 -1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -4.0030 -2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.6110 -2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -1.9590 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -6.2970 -1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -6.9360 -0.3720 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0600 -2.6830 2.4310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.0270 3.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -3.0690 4.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -2.4200 6.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -2.1070 6.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 -1.4840 8.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -1.1520 8.7210 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -1.4630 8.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -2.0860 6.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 1.9430 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 1.8900 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 1.9270 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.0160 2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -4.7630 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -4.4760 -3.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -2.0210 -3.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -3.6940 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -1.3810 3.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -1.3980 3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -3.7350 4.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -3.7170 4.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 -2.3400 6.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -1.2260 8.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -1.1890 8.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 -2.3010 6.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.6180 -1.2350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -6.8110 -2.6320 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 38 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 2 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 M CHG 1 12 -1 M END