IFLAB-ZINC04163770 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.0410 1.5320 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 0.0030 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5070 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -1.8400 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -2.5580 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9050 -2.4420 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7970 -3.9680 -0.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1860 -4.2830 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1740 -4.5680 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6240 -5.0190 -1.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8860 -5.5700 -1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6990 -5.6700 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2490 -5.2200 0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9840 -4.6740 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0760 -6.2700 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 -4.4220 1.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -5.6010 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -6.2870 0.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -6.0640 2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -5.3360 3.5190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -7.3920 2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -8.5840 2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -9.5920 2.8770 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -10.5220 3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -9.1210 2.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -7.7320 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 -6.9900 2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 -7.6260 1.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -8.9980 2.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 -9.7440 2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 -8.7310 3.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 1.9150 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 1.8920 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 1.8800 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -0.3450 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -0.3570 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4410 -2.1220 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 -2.1100 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 -4.9410 -2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2380 -5.9220 -2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8840 -5.2980 1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6310 -4.3250 1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0210 -7.3450 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7370 -5.8190 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4670 -6.0790 -1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 -3.8740 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 -5.9210 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 -7.0530 1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5340 -9.4870 2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 -10.8120 2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9250 -8.9890 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 -9.5190 3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 -7.7900 3.5770 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 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 31 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 M END