CHEMDIV-ZINC04192564 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.1490 1.5900 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 0.1110 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -0.4750 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -1.8450 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -2.6370 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -2.0700 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -0.6900 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.8500 -2.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -3.8540 -2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -2.6520 -3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 -1.7770 -2.9950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -3.5590 -4.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 -3.9600 -4.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 -3.2140 -5.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -1.9730 -6.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4490 -1.5070 -6.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6140 -2.2590 -7.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7320 -3.4880 -6.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6420 -3.9480 -5.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4740 -5.0940 -4.8980 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 -5.1210 -4.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 -6.2080 -3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -5.9140 -2.7080 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.4900 -6.1060 -4.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -3.9850 0.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -4.6720 0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 2.1040 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 1.8180 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 1.9840 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 0.1300 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -2.3050 2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -0.2080 -2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -4.8470 -2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -3.8350 -3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 -3.6410 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -2.9970 -5.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -4.4640 -4.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 -1.3760 -6.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3750 -0.5520 -7.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4470 -1.8860 -7.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6490 -4.0620 -6.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2630 -6.9580 -5.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5000 -6.3930 -3.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4750 -5.7060 -4.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -4.4000 1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -4.4780 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -5.7450 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1170 -7.3760 -3.7770 O 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 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 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 21 2 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 48 2 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 M CHG 1 23 -1 M END