IFLAB-ZINC04316959 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.5620 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.4340 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -3.9380 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 -4.7050 0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -6.3870 0.5510 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 -5.8960 -0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -4.6030 -0.9150 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 -6.7560 -1.6850 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -8.0880 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 -8.5360 -0.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -9.0210 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -10.7320 -1.9020 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -11.5810 -3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -12.9950 -3.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -13.6200 -4.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -12.8690 -5.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 -13.3100 -5.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -11.5280 -5.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 -10.8810 -5.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -10.8970 -4.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -15.1180 -4.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 -15.7620 -2.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -15.2010 -2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -13.7300 -2.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -2.1110 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -2.1010 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9830 -4.3560 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -6.3980 -2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -8.8890 -3.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -8.7980 -2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -15.4900 -4.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 -15.3810 -4.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -16.8430 -2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -15.5250 -2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -15.2900 -3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 -15.7530 -1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -13.6580 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 -13.2740 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 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 36 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 24 2 0 0 0 0 18 19 2 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 M END