IFLAB-ZINC04341699 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3770 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 1.2140 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4150 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 2.3090 -0.0230 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -2.0810 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -2.8650 -0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -4.2010 -0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -4.1660 0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -2.9200 0.6400 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5770 -5.2270 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -4.8850 -1.7090 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 -3.6170 -1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2130 -2.6250 -1.4310 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 -6.9210 -0.6730 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 -7.7120 -1.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 -9.2100 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -9.6940 -0.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 -10.0100 -2.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1370 -11.4660 -2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 -12.1230 -3.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6590 -13.6430 -3.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3480 -14.1280 -1.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6910 -13.4720 -0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8260 -11.9520 -0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -0.4900 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -5.0260 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7770 -3.3850 -2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4460 -7.4130 -2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 -7.4040 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 -9.6230 -2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0810 -11.7360 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3030 -11.7770 -4.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8500 -11.8530 -3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 -13.9120 -3.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1270 -14.1110 -4.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -15.2120 -1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4040 -13.8590 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -13.7410 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1820 -13.8180 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8820 -11.6820 -0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 -11.4840 0.1050 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 16 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M END