IBS-ZINC02121912 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 1.0380 -0.5820 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0070 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6400 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -0.1360 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -0.7780 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -1.9290 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 -2.4330 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -1.7870 -0.7300 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 -7.9210 -4.3120 -1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3440 -4.7060 -2.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7350 -6.0070 -3.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1310 -6.3290 -4.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1310 -5.3640 -5.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7250 -4.0710 -5.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3210 -3.7360 -3.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8770 -2.4880 -3.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1580 -1.9870 -2.1360 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 1.9430 0.0200 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -1.5960 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -0.6070 -1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 0.7600 1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -0.3850 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -3.3280 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -2.1770 -1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -3.5470 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7030 -5.0580 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7290 -6.7620 -2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4420 -7.3370 -4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4500 -5.6230 -6.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7240 -3.3250 -5.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2170 -1.7400 -2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5680 -1.0870 -1.9620 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 23 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 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 42 1 0 0 0 0 23 43 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 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 M END