IBS-ZINC06719936 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -0.4080 1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -1.9280 1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 -2.2690 2.9440 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2920 -1.7880 3.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -3.7620 3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 -4.3650 3.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 -1.7910 2.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8640 -1.5100 3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 -1.6530 5.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 -1.0180 3.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8540 -0.7760 5.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2850 -0.2440 5.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0700 -1.1780 4.2930 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5650 -1.5500 2.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1310 -2.0680 3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4970 -1.8000 4.8580 S 0 0 0 0 0 0 0 0 0 0 0 0 10.2510 -2.1780 3.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9740 -0.8860 5.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1130 -3.2910 5.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0950 -4.4940 5.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7940 -5.6640 5.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5110 -5.6310 7.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5300 -4.4270 7.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8350 -3.2580 7.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 0.0240 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -0.0010 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.3610 1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -2.3350 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 -1.6760 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3010 -0.0860 3.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2360 -0.0460 5.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 -1.7140 5.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2710 0.7360 4.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 -0.1640 6.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5740 -0.6760 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1950 -2.3310 2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1340 -2.9920 3.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7110 -2.2560 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3160 -4.5210 3.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7790 -6.6040 5.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2750 -6.5440 7.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3090 -4.4010 8.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8540 -2.3190 7.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -4.4230 3.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -5.3800 3.4020 H 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 3 4 1 0 0 0 0 3 30 1 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 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 49 1 0 0 0 0 9 10 1 0 0 0 0 9 34 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 17 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 49 50 1 0 0 0 0 M END