IBS-ZINC05196287 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 55 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5240 -1.7810 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.3430 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1570 -0.9170 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 -1.8240 2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 -2.3620 3.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 -2.0270 4.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 -1.1540 4.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -0.5780 3.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9670 0.3300 3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2720 0.8690 2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5400 0.5370 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8850 1.1090 -0.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5120 0.5440 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -0.3330 -1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1180 -0.8960 -2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 -0.5260 -3.6380 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 0.3550 -3.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1770 0.8570 -2.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5130 -1.0810 -4.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 -0.1940 -5.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7810 0.8480 -6.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 1.3910 -6.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 0.6470 -6.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -0.3150 -5.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 -2.0910 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -3.0580 3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 -2.4680 5.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1120 -0.9050 5.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5430 0.5980 4.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0920 1.5660 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4330 0.6420 -4.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4160 -1.1340 -5.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 -2.0810 -4.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 1.2040 -6.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 2.2400 -7.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 0.7960 -6.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 -1.7510 -2.6170 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -2.0020 -1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 49 2 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 30 2 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 48 1 0 0 0 0 49 50 1 0 0 0 0 M END