IFLAB-ZINC04138985 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 0.0440 1.5220 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -0.0080 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -0.5320 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -2.0380 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -2.6760 1.1600 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -4.0010 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -4.7150 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -3.9960 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -2.6630 -1.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -4.8280 -2.7740 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -3.4060 -3.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -3.8900 -5.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -5.0790 -5.5580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -3.0010 -6.3330 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -3.4440 -7.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 -4.6550 -7.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -5.0900 -9.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 -4.3220 -10.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 -3.1170 -9.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 -2.6790 -8.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -1.3680 -8.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -6.1800 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -6.8400 -0.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 -6.7770 1.2440 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -6.0520 2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -6.6380 3.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 -4.7080 2.3800 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -3.9870 3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -8.2390 1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 1.8950 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 1.8850 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 1.8760 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -0.3620 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -0.3710 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -0.1780 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 -0.1690 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -2.8110 -3.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -2.7950 -3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 -2.0530 -6.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -5.2550 -7.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -6.0310 -9.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -4.6650 -11.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 -2.5190 -10.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -0.5640 -8.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 -1.1760 -9.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 -1.4160 -7.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -3.8180 3.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -4.5780 4.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -3.0290 3.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -8.5920 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 -8.5570 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -8.6570 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 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 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 M END