IFLAB-ZINC04139259 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -1.5470 1.0160 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -0.2360 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -0.6990 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -1.8480 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -2.5370 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.0760 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 -0.9240 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.7710 -2.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -4.1140 -2.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -4.7270 -1.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -4.8520 -3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -6.3530 -3.4660 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2130 -6.5320 -2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -7.0800 -4.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -7.9200 -5.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -8.0540 -2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -8.5270 -1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 -9.4240 -2.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -9.8320 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 -9.3340 -0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -8.4820 0.3590 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 -8.0760 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 1.8820 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 0.9540 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 1.1190 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -0.1620 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -2.2060 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -3.4340 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.5650 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -2.2880 -3.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 -4.6640 -4.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -4.5050 -4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -7.8270 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -8.8350 -2.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -9.7970 -3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5510 -10.5300 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1310 -9.6470 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -7.3810 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 -6.7930 -5.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 -6.8440 -2.8470 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 -6.1260 -2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -7.2850 -6.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 40 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 22 38 1 0 0 0 0 39 42 1 0 0 0 0 40 41 1 0 0 0 0 M END