IFLAB-ZINC00150011 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 1 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 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2850 -0.0870 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -2.0370 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -0.1040 1.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 -0.4580 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -1.1550 -0.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3180 0.1440 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5420 0.1250 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6180 0.8120 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4760 1.5250 1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2450 1.5500 2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1680 0.8630 1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 0.6780 2.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 1.1510 3.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6320 2.2560 2.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5100 2.8770 3.1450 O 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 -1.0200 -0.3810 0.0100 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 1.1120 -2.4610 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -2.3980 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -2.3400 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6570 -0.4260 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5720 0.7960 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 2.1010 3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8190 2.2320 1.4730 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5450 2.7250 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 2 0 0 0 0 17 30 1 0 0 0 0 30 31 1 0 0 0 0 M END