PUBCHEM-ZINC06036919 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.2330 1.0610 -0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -0.4440 -0.0290 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1860 -0.8140 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -0.8110 1.2130 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7280 -0.4890 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -0.0790 2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 -0.3410 3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 -0.2280 3.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -2.3270 1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 -3.0520 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 -4.4380 1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -5.1180 1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4150 -4.4130 1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -3.0270 1.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -1.0240 -1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -0.8840 -1.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 1.5210 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 1.2730 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 1.5640 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 1.0060 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -0.3130 2.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 -2.5320 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 -4.9810 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -6.1950 1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -4.9390 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -2.4960 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -0.5920 4.7800 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4700 -1.5450 -2.1030 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 M CHG 1 27 -1 M CHG 1 28 -1 M END