PUBCHEM-ZINC05360219 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 30 0 0 1 0 0 0 0 0999 V2000 0.5290 0.7490 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -0.5010 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 -0.8650 1.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -0.2890 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -0.2690 -1.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6630 -0.5940 -2.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6230 0.1390 -1.4600 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1020 0.4510 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4680 0.2180 -2.6610 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8260 0.3910 -3.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3090 -1.0560 -2.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 -2.2950 -3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2770 -3.5700 -3.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5140 -3.5340 -3.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4930 1.3870 -2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7480 1.7280 -1.3330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 0.5850 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 1.0120 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 1.6110 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -1.3330 -0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -0.0700 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -1.7850 1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -1.0310 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 -1.1090 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 0.6440 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8920 -1.2520 -1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0410 -0.8980 -3.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8550 -2.0850 -4.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8030 -2.5290 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 -4.5300 -3.9220 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.9220 1.8700 -3.6170 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 20 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 M CHG 1 30 -1 M CHG 1 31 -1 M END