IBS-ZINC02137997 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 0.7270 0.0260 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 0.1670 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -0.3510 -1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -0.6480 -0.0300 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1520 -1.6790 0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 -0.0560 1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2190 0.6150 0.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 -0.2710 2.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 0.2060 3.4250 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2640 1.1500 3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9060 -0.8300 3.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 0.4120 4.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 0.1840 4.6930 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -0.6180 -1.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -1.7810 -1.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -2.8490 -1.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2470 -1.7230 -3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -2.8780 -3.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3450 -2.7690 -5.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 -1.5220 -5.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2610 -0.3700 -4.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 -0.4590 -3.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1480 0.6740 -2.9910 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3560 1.5520 -3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 0.5650 -1.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 1.5820 -1.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6810 0.5340 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 0.4740 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -1.0300 1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 1.2160 -0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -1.4210 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -0.1660 -2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 0.1670 -1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -0.7420 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4830 -0.9790 2.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4510 -1.7740 3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5640 -0.4760 4.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4090 -3.8500 -3.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6570 -3.6620 -5.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2000 -1.4520 -6.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 0.5970 -5.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6170 0.8490 5.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 0.9660 6.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 42 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 42 43 1 0 0 0 0 M END