IFLAB-ZINC04376756 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 37 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0300 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 2.1860 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 2.5060 -1.7340 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6800 3.4020 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2520 3.7310 -0.4060 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3400 4.3830 -0.6270 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5250 4.5090 -1.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4660 3.8760 -2.5470 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3900 3.8380 -3.9400 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3270 4.4000 -4.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4270 5.0530 -4.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5240 5.1140 -2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2280 4.3490 -6.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2320 3.7580 -6.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5410 3.9480 -8.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6970 4.6380 -8.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1070 4.8840 -7.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -0.6290 -0.0350 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.7590 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 3.1670 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 3.1340 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 1.6060 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1870 5.5100 -4.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3630 5.6100 -2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3720 3.2420 -6.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9600 3.6050 -9.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2070 4.9470 -9.1720 H 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 M END