IFLAB-ZINC04270372 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 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 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -4.7670 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -4.9600 -2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 -4.6880 -3.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9870 -4.2240 -3.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 -4.0260 -1.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -4.3060 -0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8340 -3.5280 -1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2440 -3.3560 -0.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6320 -3.2620 -2.8020 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.9230 -2.7940 -2.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7690 -2.5090 -3.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9570 -2.0740 -3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1220 -1.9870 -1.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6290 -2.5160 -1.0630 S 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 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 -5.3240 -2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 -4.8400 -4.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6250 -4.0120 -4.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9960 -4.1600 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3040 -3.3990 -3.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7320 -1.8090 -3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0150 -1.6550 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 M END