IBS-ZINC05352519 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 1.4490 -1.8550 2.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -1.4760 0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 -2.0820 1.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -1.8440 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1620 -1.1500 -0.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 -2.4270 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7490 -2.1810 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0130 -2.7270 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4200 -3.5210 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5520 -3.7670 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 -3.2300 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7040 -4.0730 0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9280 -5.3890 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0720 -6.2400 -0.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4190 -5.6450 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0240 -4.2340 0.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.6610 -3.9990 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8110 -3.3290 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8380 -2.1220 0.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8110 -3.0820 1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5770 -2.9970 2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6340 -1.9280 2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5180 -0.6510 2.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6820 0.0230 2.6570 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.8380 0.9590 2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6000 -0.8260 2.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9820 -2.0840 1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6820 -3.1520 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9650 -2.9700 0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5780 -1.7300 1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9080 -0.6640 1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -1.4000 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -1.4960 3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -2.9390 2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -0.3920 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -1.8350 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 -1.5640 -1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6900 -2.5380 -1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8720 -4.3830 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 -3.4260 1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7540 -6.1120 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6770 -6.2640 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5030 -3.3290 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3390 -2.1220 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0490 -3.9570 2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8850 -2.7500 3.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6350 -0.2180 3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2110 -4.1200 1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.5060 -3.7960 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.5930 -1.6010 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3940 0.2970 1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7810 -4.1240 1.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1860 -5.0110 1.6410 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 11 2 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 52 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 52 53 1 0 0 0 0 M END