IFLAB-ZINC04940459 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 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 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8240 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -2.3500 2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 -3.7160 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -4.5690 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -4.0370 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -2.6700 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -6.0380 1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -6.5170 2.8200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 -7.8320 3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -8.6960 2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -8.1430 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -6.8290 0.8390 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -9.2070 0.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -10.3520 0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -11.4700 0.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 -10.0710 1.9130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -10.7220 2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -9.1090 -1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -7.8620 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -7.7660 -2.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 -8.9100 -3.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 -10.1590 -2.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -10.2590 -1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -11.2830 -3.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6350 -11.1050 -4.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 -8.3630 4.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7300 -9.5630 4.3440 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -7.5150 5.0980 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 -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 1.8870 -1.6890 3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 -4.1240 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -4.6950 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -2.2580 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -6.9660 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 -6.7950 -3.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -8.8320 -4.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -11.2300 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5590 -10.5630 -4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -10.5370 -5.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 -12.0790 -5.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 -6.5570 4.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6070 -7.8630 5.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 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 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 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 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 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 30 2 0 0 0 0 29 31 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 M END