PUBCHEM-ZINC05688709 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2810 -0.7190 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -0.6920 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3050 -0.0470 0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 -0.7290 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5770 -2.0700 0.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 -2.3740 0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5550 -1.2430 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6900 -0.2020 0.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9380 -1.1580 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7130 -2.3290 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0990 -2.2440 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9990 -3.3290 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2720 -2.7830 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1300 -1.4110 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8280 -1.1060 0.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2410 -0.4330 0.1170 N 0 3 0 0 0 0 0 0 0 0 0 0 -13.4890 -0.8540 0.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9810 0.8580 0.1210 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 -0.9020 1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -1.6700 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -0.1170 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -1.7720 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4200 -0.1910 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2320 -3.2950 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7460 -4.3790 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2040 -3.3300 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END