IBS-ZINC02336019 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3880 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 1.1810 -0.6880 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 0.0180 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.4340 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 2.1060 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 2.1400 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 1.4810 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8460 0.0880 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 -0.6750 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7400 -2.1430 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 -2.7440 -0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 -4.1440 -0.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9780 -4.9710 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0350 -6.2050 -0.7180 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0470 -6.2080 0.5670 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0030 -4.9760 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0060 -4.4860 2.7150 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 -4.5500 -2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2880 -5.4530 -3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 -5.0540 -4.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 -3.7600 -5.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 -2.8590 -4.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5670 -3.2480 -2.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8550 -3.3750 -6.5290 F 0 0 0 0 0 0 0 0 0 0 0 0 6.0540 -0.5290 -0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.5500 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -1.7680 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 3.1850 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 3.2200 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6960 2.0510 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 -2.7220 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6190 -4.4780 2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 -6.4620 -3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5210 -5.7530 -5.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2560 -1.8510 -4.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 -2.5470 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4130 -0.7120 0.8220 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 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 38 1 0 0 0 0 26 39 1 0 0 0 0 M END