IFLAB-ZINC02686356 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -4.7670 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -4.9600 -2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 -4.6900 -3.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9850 -4.2250 -3.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4610 -4.0270 -1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 -4.3070 -0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8290 -3.5310 -1.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2390 -3.3600 -0.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7210 -3.2360 -2.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0790 -2.7380 -2.4310 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.0330 -2.5510 -3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0060 -1.7430 -4.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0480 -1.7890 -5.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1120 -2.6460 -5.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1410 -3.4560 -4.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0960 -3.4160 -3.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8970 -4.1250 -2.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7450 -3.7900 -1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3200 -4.2460 -0.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9260 -1.5160 -1.7050 O 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 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -5.3230 -2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 -4.8420 -4.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6220 -4.0140 -4.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 -4.1600 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2600 -2.4690 -3.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8610 -4.1440 -3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1740 -1.0750 -4.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0300 -1.1560 -6.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9240 -2.6820 -6.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9760 -4.1230 -4.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5190 -4.7830 -1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3470 -1.5870 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 39 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 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 21 31 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 31 51 1 0 0 0 0 M END