IBS-ZINC04980907 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 1.7140 2.9500 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 2.7680 2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 4.5480 1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 4.6690 2.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 6.1190 2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 6.2350 3.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 6.5400 4.7730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5760 5.7700 5.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5660 6.5560 5.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 6.2720 4.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6690 6.0840 3.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 5.8300 2.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6710 6.1960 4.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8860 6.8010 6.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1790 6.9130 7.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 6.9400 7.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 8.0130 8.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 8.1380 9.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 7.2060 9.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 6.1360 8.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 5.9960 7.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 5.2240 8.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 5.4280 9.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5310 7.8880 4.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 8.9680 4.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 10.2060 4.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 10.3660 5.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 9.2840 5.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 8.0440 5.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 9.4390 6.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 10.7450 6.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 1.9110 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 3.6050 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 3.1790 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 3.3700 2.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 1.7140 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 2.9310 3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 4.8440 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 5.1990 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 4.0190 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 4.3730 3.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 6.7690 2.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 6.4150 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3030 7.0840 8.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 8.7430 8.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 8.9670 10.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 7.3100 10.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 5.1620 7.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 6.3890 9.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 5.4180 10.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 4.6310 9.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 8.8440 3.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7410 11.0480 3.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 11.3340 5.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 7.2010 6.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 10.7300 7.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 11.0500 5.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 11.4520 7.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 3.1570 1.2330 N 0 0 0 0 0 0 0 0 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 1 59 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 2 59 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 59 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END