IFLAB-ZINC04517522 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0600 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -2.1650 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -2.6620 1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -1.8820 1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3410 -0.7050 1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8860 -0.1040 1.6110 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.1270 -1.4550 2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 -2.3240 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0040 -3.5520 3.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9450 -4.5270 3.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2360 -1.6470 3.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2200 -0.7260 3.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1340 0.2730 2.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4030 -0.9300 4.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5030 -2.0760 5.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6080 -2.2650 5.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6180 -1.3220 5.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5280 -0.1770 5.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4190 0.0250 4.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8200 1.0210 5.1930 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.9990 0.3110 6.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 0.0010 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -2.5230 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -2.5340 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -3.7230 1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -2.5110 2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3040 -2.4440 3.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7160 -2.8160 5.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6840 -3.1530 6.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4810 -1.4760 6.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3450 0.9150 3.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8540 0.9790 6.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3380 -0.6590 6.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5140 0.1870 7.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 1.0390 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -0.0400 -0.9560 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 3 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END