PUBCHEM-ZINC01631881 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.7700 1.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.0550 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.0860 -0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7850 -1.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.3260 -2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -0.1460 -2.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 0.3130 -4.3870 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 0.5400 -5.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 0.3650 -4.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 1.0120 -6.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9350 1.1930 -6.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 1.6520 -8.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9980 0.8650 -9.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 1.6890 -10.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 2.9440 -10.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 2.9290 -8.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 4.1160 -7.9170 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6460 3.9820 -6.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 5.2250 -8.4080 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0330 -3.2940 -1.5290 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0520 -4.4000 -1.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -3.1820 -2.7410 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -2.9140 1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -1.0650 -3.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 0.6250 -2.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 0.5920 -2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -1.0980 -2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 0.4530 -4.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 0.2740 -7.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 1.9640 -6.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 1.9310 -6.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4630 0.2410 -6.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 -0.2100 -9.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9730 1.3910 -11.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 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 34 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 18 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 22 1 M CHG 1 24 -1 M END