IFLAB-ZINC04248586 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 36 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 1.2230 -0.6920 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -2.0450 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.7520 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -2.1110 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 -0.7060 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -3.0260 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 -4.2390 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -4.1090 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -5.1600 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -4.9040 -0.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -6.5600 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 -7.6450 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -8.8150 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -10.1950 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -11.0470 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -10.5510 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -9.1930 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -8.3060 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -6.9610 -0.0240 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 2.1520 -0.1420 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 -2.5680 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 -0.1870 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 -5.1690 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -7.6440 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -10.5860 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -12.1150 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 -11.2370 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 -8.8180 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 M END