IFLAB-ZINC04279330 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 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 0.0230 -0.7980 1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.1000 0.8380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -2.4620 -0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -1.0300 -1.4310 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -3.7740 -0.8620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -4.0290 -2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -3.1120 -2.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -5.4530 -2.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -5.4620 -4.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -6.8860 -4.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -7.5560 -4.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -8.8620 -5.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -9.4980 -5.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -8.8270 -5.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -7.5200 -4.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.2550 2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -0.9280 3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -0.4200 4.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 0.7600 5.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 1.4330 4.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 0.9270 2.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 1.2580 6.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 2.4760 6.5240 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 0.0620 -4.5080 -0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 -5.9520 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -5.9770 -2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -4.9630 -4.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -4.9380 -4.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -7.0590 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 -9.3850 -5.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -10.5180 -5.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 -9.3240 -5.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 -6.9950 -4.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -1.8450 3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -0.9400 5.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 2.3510 4.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 1.4480 1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 2.3320 6.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 3.2630 5.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 2.7620 7.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 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 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END