IFLAB-ZINC04942179 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 0.0640 1.4590 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -0.0060 -0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -0.6960 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 -2.1020 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -2.8230 2.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -2.0930 3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -0.7160 3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -0.0630 2.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -4.5840 2.3760 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -4.8890 4.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -6.3740 4.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -7.1500 3.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -6.8400 5.6810 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -8.2180 5.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -9.1150 5.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -10.4730 5.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -10.9420 6.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 -10.0550 7.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -8.6910 7.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -7.8170 7.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 -8.3740 9.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -2.7720 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -3.9860 -0.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -2.0040 -1.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -0.6650 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.0190 -2.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -2.6450 -2.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 1.8280 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 1.8240 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 1.8150 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -2.6030 4.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -0.1550 4.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 -4.4390 4.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -4.4490 4.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -6.2220 6.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -8.7510 4.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -11.1700 4.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -12.0050 6.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 -10.4250 8.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -7.5700 9.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 -9.0230 8.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -8.9530 9.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -2.8100 -2.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -2.0000 -3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -3.6010 -2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 25 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 22 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 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 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 2 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M END