IFLAB-ZINC04134664 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 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 1.0600 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -0.7580 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -2.1560 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -2.8600 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -2.1780 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6670 -0.7820 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 -0.0760 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9190 -2.9360 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9030 -4.1510 0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0960 -2.2780 0.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2880 -2.9880 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4710 -2.4610 0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.5060 -3.3020 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1810 -4.6110 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4250 -4.7430 0.0360 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.9060 -2.8330 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2690 -1.5940 0.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.5870 -1.3240 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2330 -0.0690 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5920 0.0100 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.3700 -1.1390 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7680 -2.3770 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3790 -2.4780 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3160 -3.8830 0.0860 S 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 -0.3040 -2.6840 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 -3.9400 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6100 -0.2560 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 1.0040 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1090 -1.3080 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8780 -5.4360 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6440 0.8370 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0700 0.9790 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.4470 -1.0610 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3740 -3.2710 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 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 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 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 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 M END