IFLAB-ZINC04315071 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 0.4370 1.5870 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 0.1330 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -0.6940 1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -2.0620 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -2.6220 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.8080 -0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -0.4340 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -2.2970 -1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -4.0000 -0.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -4.6580 -1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 -4.1630 -2.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -6.1770 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 -8.1710 -2.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 -8.6640 -4.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -8.6240 -4.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 -7.2140 -4.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 -6.7290 -2.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6640 -9.1520 -5.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 -8.5550 -6.8830 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -7.7110 -7.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 -9.3050 -7.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 -9.1620 -9.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5350 -10.1420 -10.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1890 -11.2060 -9.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 -11.3250 -8.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -10.3520 -7.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3780 -10.2420 -5.8860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -2.8720 2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 1.7250 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 2.1760 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 1.9840 1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 -0.2650 2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 0.2030 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -2.2060 -2.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -1.7020 -1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 -3.3260 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 -4.5400 0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -6.5580 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 -6.4900 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -8.8190 -1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -8.1060 -2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 -8.0480 -4.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -9.6870 -4.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6930 -9.2930 -3.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -6.5110 -4.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8810 -7.2050 -4.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 -5.6890 -2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -7.3530 -1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 -8.3370 -9.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5490 -10.0730 -11.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7030 -11.9520 -10.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6970 -12.1490 -7.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 -3.3510 1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 -3.6330 2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 -2.2480 2.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -6.7910 -2.5460 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4950 -6.1520 -3.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 56 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 13 56 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 17 56 1 0 0 0 0 18 19 1 0 0 0 0 18 27 2 0 0 0 0 19 20 1 0 0 0 0 19 21 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 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END