IFLAB-ZINC05257947 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 -0.2440 0.6280 1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -0.8620 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -1.7210 2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -3.0880 2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -3.6000 0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -2.7400 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -1.3670 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -3.2550 -1.5220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -4.7030 -1.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -4.9980 -3.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -6.7710 -4.8840 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5320 -6.0060 -5.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -8.1320 -5.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -8.0510 -4.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 -7.0070 -4.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 -9.1380 -4.8290 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 -9.0350 -4.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 -10.1060 -4.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 -10.0010 -3.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9730 -8.8320 -4.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2920 -7.7660 -4.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9380 -7.8660 -4.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0160 -6.5160 -4.9610 N 0 3 0 0 0 0 0 0 0 0 0 0 8.2100 -6.4290 -4.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4170 -5.5760 -5.4510 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4410 -6.8180 -5.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 -6.6060 -4.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 1.0290 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 1.0970 0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 0.8350 2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -1.3230 3.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -3.7560 2.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -4.6680 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -0.6960 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -2.6540 -2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -5.1010 -1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 -5.1730 -1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -4.6000 -3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -4.5280 -3.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -8.8820 -4.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -8.4110 -6.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -9.9920 -5.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4210 -11.0180 -3.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8350 -10.8330 -3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0320 -8.7530 -3.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 -7.0330 -5.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -6.4500 -3.4510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -6.8520 -2.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 -7.0960 -6.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6170 -7.1150 -6.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 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 9 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 47 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 11 47 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 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 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 47 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END