NCID-ZINC04528645 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 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 0.6250 -0.6180 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 0.1360 2.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -0.4890 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 -1.8720 3.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -2.6380 2.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -2.0180 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -2.7710 0.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -4.0590 0.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -4.8100 -0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -4.1780 -1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -4.9040 -2.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 -6.3110 -2.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 -7.0790 -3.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -8.4390 -3.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 -9.0830 -2.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -8.3710 -1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -6.9670 -1.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -6.2010 -0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -6.8110 0.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 -4.0840 -4.2070 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -3.7470 -5.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -4.8760 -4.5420 O 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 1.1640 1.2150 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 0.1030 3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 -2.3510 3.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 -3.7160 2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -3.0990 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 -6.5940 -4.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 -9.0260 -4.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -10.1620 -2.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -8.8840 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -7.0000 1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 -2.7680 -3.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 -2.2340 -4.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 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 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 38 1 0 0 0 0 38 39 1 0 0 0 0 M END