IFLAB-ZINC02723960 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 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 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 0.1000 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 -0.5300 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6710 -1.9080 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 -2.6730 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -2.0530 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -2.9320 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -4.1880 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -4.4180 0.0010 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -5.2110 -0.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -6.4950 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -6.7560 -0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -7.5850 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 -7.2880 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 -8.2830 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 -9.6370 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -9.9340 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -8.9130 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 -11.6870 -0.1290 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0450 -11.8810 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 -10.7510 -0.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8840 -2.5240 0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0380 -1.6830 0.0520 C 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 -2.3110 1.1790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 0.0590 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 -5.0030 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -6.2580 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 -8.0370 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -9.1480 -0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -12.8380 -0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0210 -1.0580 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0380 -1.0490 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9370 -2.2990 0.0570 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 11 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 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 24 25 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 M END