IFLAB-ZINC02455095 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 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 -2.3740 0.0990 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5460 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -1.9280 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 -2.6700 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -2.0290 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -2.7810 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -3.5910 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -4.1670 -0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -3.6740 0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -2.8050 0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -2.2080 2.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -2.4250 2.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 -3.2310 2.6060 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 -3.8790 1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 -4.9510 0.9920 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 -5.1100 -1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 -6.2230 -2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 -7.0970 -2.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -6.8720 -3.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 -5.7700 -2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -4.8840 -1.8440 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 -2.3340 1.1790 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0300 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6100 -2.4280 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 -3.7490 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -3.7470 -1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -1.9240 3.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -6.4000 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8890 -7.9590 -3.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 -7.5590 -3.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 -5.5990 -2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 -4.0220 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 -4.0320 0.3450 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 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 19 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 14 15 1 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 17 18 1 0 0 0 0 18 39 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 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 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 M END