PUBCHEM-ZINC04822315 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 1.0730 1.3700 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -0.0720 -0.0320 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4320 -0.8350 -0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -2.1980 -0.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -2.7660 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -1.9140 0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -0.5640 0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.2130 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -4.8890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -6.3530 -1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -7.1800 -0.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -6.6310 -2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -7.8270 -3.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -7.8140 -4.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -6.6170 -5.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -5.4190 -4.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -5.4140 -3.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -4.3000 -2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -3.1160 -2.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 1.8660 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 1.7630 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 1.5530 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 -0.3870 -1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 -2.8170 -1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -2.3090 1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 0.1000 1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 -4.7400 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 -8.7660 -2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -8.7440 -5.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -6.6170 -6.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2530 -4.4870 -5.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 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 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 18 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 2 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 M CHG 1 2 1 M END