IFLAB-ZINC04248449 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 1.2260 -0.6930 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -2.0420 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -2.7560 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -4.0990 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -4.2440 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -3.0320 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -2.1120 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -0.7030 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -5.5550 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 -5.5980 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9460 -6.8730 1.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8510 -7.1350 2.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0690 -6.3140 3.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5790 -8.4190 2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5180 -8.6930 3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1950 -9.8920 3.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9450 -10.8300 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0110 -10.5620 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3350 -9.3620 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6140 -12.0110 2.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3080 -12.9290 1.0890 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 2.1540 -0.1400 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 -2.5620 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -4.8950 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 -0.1840 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 -5.6510 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 -6.3760 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 -5.5020 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -4.7770 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 -7.5280 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7130 -7.9650 3.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9210 -10.1050 3.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8190 -11.2930 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -9.1520 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2500 -13.1910 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9100 -13.8300 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5290 -12.4660 0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 10 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 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 29 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M END