PUBCHEM-ZINC05125479 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 0.0330 1.1970 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -0.0050 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -0.5140 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 0.2170 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 1.4330 0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 1.9120 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 2.1570 0.4220 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 2.7540 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1130 3.4980 -0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4090 4.1340 -2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 4.8270 -2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5220 4.8880 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2030 4.2490 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0120 3.5490 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1520 4.3170 1.1840 N 0 3 0 0 0 0 0 0 0 0 0 0 7.8470 5.0090 2.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2290 3.7260 1.0230 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9630 -1.8110 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -2.1870 -1.6920 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8320 1.5740 1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 -0.5550 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 -0.1680 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 2.8450 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1930 2.7160 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 4.0910 -2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8460 5.3150 -3.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4600 5.4250 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7460 2.9120 1.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -2.4250 -1.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 2.4740 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 24 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 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M CHG 1 19 -1 M END