IBS-ZINC02112603 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 1.0960 -0.6720 0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0010 -0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -0.6350 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 -0.0390 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5300 -0.6830 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 -1.9280 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -2.5240 0.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 -1.8810 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -2.5810 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0270 -1.8670 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9840 -0.6550 0.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3520 -2.5750 0.2740 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.2400 -3.4460 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8140 -3.0160 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6470 -2.3500 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8360 -3.0580 -3.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3970 -2.7780 -3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1090 -4.2270 -3.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4320 -4.2490 -1.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6050 -5.3260 -1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4540 -6.3540 -2.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1160 -6.3360 -3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9440 -5.2860 -3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3410 -1.6630 0.8530 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1720 -1.6760 2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7740 -0.3240 1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8520 -0.4690 0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6390 0.2490 -0.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 -0.0590 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -0.8400 1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -1.6300 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 0.9290 -1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 -0.2190 -1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 -3.4920 1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -2.3460 1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -3.5480 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1020 -1.3960 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0860 -5.3470 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8130 -7.1870 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9870 -7.1550 -4.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4540 -5.2800 -4.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9040 -2.4830 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5890 -1.6390 2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8350 -0.3580 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5120 0.4920 2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 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 M END