IFLAB-ZINC05143574 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8490 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -2.6770 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -4.0610 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 -4.6060 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 -3.7760 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -2.3990 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 -1.5850 0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9520 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 -4.4100 -0.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 -5.1730 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 -6.5600 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -7.0930 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -6.2670 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -8.4700 -0.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -8.7690 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 -9.8940 -0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 -7.6330 -0.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6160 -7.5780 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -9.3970 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -8.9560 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7920 -9.8730 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -11.2280 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -11.6700 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -10.7580 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -13.1480 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6460 -12.2250 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2770 -4.5610 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 -5.2690 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 -3.2200 -0.0610 N 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 0.6020 -2.2520 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9720 -5.6780 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9370 -4.2000 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 -1.3450 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -7.8980 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -9.5300 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 -11.1040 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -13.4990 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -13.3310 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -13.6810 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9300 -12.4610 -1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 -13.1350 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 -11.8000 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -2.6550 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2920 -2.8190 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 M END