PUBCHEM-ZINC06182474 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 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 3 0 0 0 0 0 0 0 0 0 0 0.0220 -0.6570 1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.0230 2.3100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -0.6830 3.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 0.0030 4.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -0.6960 5.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -2.0790 5.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -2.7660 4.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.0720 3.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -2.9680 7.4270 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -4.2420 7.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -2.0840 8.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -3.2370 7.8650 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 -4.0450 7.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -4.4950 7.5840 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2050 -5.2690 6.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8310 -5.6080 5.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 -5.1210 5.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -4.3470 5.8530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.7300 -1.2710 C 0 0 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 0.0360 -1.7370 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 0.9920 2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 1.0830 4.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -0.1630 6.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -3.8460 4.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -2.6090 2.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8160 -2.8280 8.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1340 -5.6320 7.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4610 -6.2390 4.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -5.3670 4.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.0170 -2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -1.3440 -1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -1.3680 -1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 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 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 M CHG 1 2 1 M END