IFLAB-ZINC04316690 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -2.0950 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7460 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -3.9640 -0.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0130 -1.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6690 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0400 -2.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.6900 -2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -2.9460 -2.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -3.6540 -4.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 -3.8930 -4.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.5100 2.4790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -1.3820 3.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.3260 2.4810 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -1.4630 4.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -2.7230 5.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -3.8100 4.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -3.8620 3.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -5.0790 5.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 -5.0820 6.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -6.2720 7.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -7.4620 6.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -7.4670 5.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -6.2830 4.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -0.2840 5.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 0.4120 5.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 1.6430 6.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 2.2940 6.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -2.0620 -3.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -3.6400 -2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 -3.5740 -2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 -1.9960 -3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 -3.0250 -5.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -4.6030 -4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8590 -4.3400 -5.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 -4.4770 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -4.2950 2.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -4.1540 7.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -6.2760 8.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -8.3910 7.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -8.3990 4.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -6.2880 3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -0.5930 6.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 0.4040 4.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 0.7210 4.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -0.2760 6.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 1.3340 7.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 2.3310 6.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 3.0840 7.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 14 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 20 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 27 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 M END