IFLAB-ZINC02458536 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 25 0 0 0 0 0 0 0 0999 V2000 -0.1760 1.1670 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.2090 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -0.8590 -0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -0.0910 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 1.2820 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 1.9270 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 3.3870 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 4.1520 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 3.7620 1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 2.6050 1.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2190 4.8630 1.7790 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 5.9840 1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 5.8830 0.7030 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 7.2130 1.8110 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -2.3380 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -2.9620 -1.2950 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0900 1.6320 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -0.7780 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0840 -0.5640 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7730 1.8430 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 3.8790 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0030 7.3040 2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 8.0470 1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -2.8480 -0.2630 O 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 17 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 22 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 M CHG 1 16 -1 M END