IBS-ZINC05029672 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 62 0 0 1 0 0 0 0 0999 V2000 -0.1150 1.6360 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 0.1060 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -0.3780 1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -0.4450 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -1.9700 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7880 -2.4850 -0.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 -4.0560 -0.1820 P 0 0 3 0 0 0 0 0 0 0 0 0 -2.4780 -4.6120 -1.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -4.9140 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 -4.2480 2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -4.8980 3.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -6.2220 3.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 -6.8880 2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -6.2340 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -6.8830 4.6560 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 -6.1460 5.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -8.3120 4.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9270 -4.2880 -0.2920 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4000 -3.8790 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4520 -3.5760 -1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5240 -4.2410 -2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0050 -3.5910 -3.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4150 -2.2670 -3.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3400 -1.6010 -2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8640 -2.2590 -1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9010 -1.6060 -4.8820 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0840 -2.3400 -6.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2280 -0.1800 -4.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2220 -5.6830 -0.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 2.0290 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 1.9810 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 1.9870 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -0.2450 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -0.0260 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -1.4680 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6830 0.0150 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -0.1680 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 -0.0290 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 -2.2480 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 -2.3860 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 -3.2190 2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 -4.3780 4.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -7.9180 2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -6.7520 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 -5.1270 5.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -6.6410 6.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -6.1220 6.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -8.4430 4.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 -8.7640 5.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -8.7940 3.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2050 -5.2710 -2.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0620 -4.1120 -4.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6580 -0.5720 -2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8100 -1.7440 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0910 -2.7560 -6.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9420 -1.6610 -6.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3550 -3.1480 -6.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1150 0.1690 -3.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5560 0.3790 -5.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2580 -0.0270 -5.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8320 -6.1140 -1.1640 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 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 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 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 7 18 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 41 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 15 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 61 1 0 0 0 0 M END