IFLAB-ZINC04339661 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -2.3830 1.6430 -0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 0.1900 -1.1160 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1260 -0.1210 -2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 0.0580 -0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -1.3980 -0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -2.2820 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -0.7130 -0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 -3.1150 0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0170 -4.5540 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 -5.6020 0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -6.9570 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 -7.3050 -0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7490 -6.2760 -1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 -4.9360 -1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6810 -4.0720 -2.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4770 -4.8720 -3.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2350 -4.4190 -4.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 -2.9930 -5.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 -2.1150 -4.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1070 -0.7600 -5.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -0.2620 -5.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -1.1370 -5.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -2.4950 -5.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 1.0810 -5.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 1.6130 -6.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 -6.3000 -3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -7.2780 -3.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3870 -5.2770 2.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 2.2880 -1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 1.7440 -1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2190 2.0150 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 0.6480 -1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 0.4650 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -1.7610 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -1.4680 -0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -3.3310 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 -1.9990 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6290 -0.4320 0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8040 -0.6940 -0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1830 -2.8070 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8990 -2.9630 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 -7.7510 1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 -8.3430 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -5.1130 -5.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1200 -2.4750 -4.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9290 -0.0870 -4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -0.7980 -6.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -3.1590 -5.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 1.5370 -6.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 1.1270 -7.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 2.6750 -6.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 -6.0930 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 -2.1390 -0.3260 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3750 -2.3870 -1.3210 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 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 6 53 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 7 53 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 8 53 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 28 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 28 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END