PUBCHEM-ZINC06473568 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2040 -0.6870 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0120 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 2.1670 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7850 1.5330 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9890 2.2500 -0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1650 1.5920 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6360 2.4670 -0.0640 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1830 0.2440 -0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3080 -0.3860 -0.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3260 -1.7250 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5180 -2.5970 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8880 -2.3520 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7710 -3.4120 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2970 -4.7150 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9420 -4.9700 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0370 -3.9150 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6530 -3.8640 -0.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0720 -4.6410 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2220 -2.5790 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9300 -2.1870 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 -0.6580 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -1.7670 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 3.2470 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9760 3.2200 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2580 -1.3380 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8350 -3.2260 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9960 -5.5380 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5840 -5.9880 -0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5410 -2.0680 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9150 -0.8480 -0.9220 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 36 1 0 0 0 0 25 37 1 0 0 0 0 M END