PUBCHEM-ZINC01057748 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 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 0.0230 -0.7100 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.1060 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.7060 -0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -1.9920 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6670 -1.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.8250 -2.7180 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -1.4410 -3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -1.6480 -5.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -0.5520 -6.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 0.7180 -5.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 0.8490 -4.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -0.2140 -3.3100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 1.9180 -6.3310 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0940 1.7960 -7.5430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 3.0290 -5.8310 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0640 -2.9080 2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -4.3000 2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -5.0410 3.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -4.4040 4.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -3.0220 4.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -2.2720 3.6260 C 0 0 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 0.0260 -0.1940 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -2.6490 -5.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -0.6810 -7.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 1.8350 -3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -4.7980 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -6.1200 3.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -4.9880 5.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -2.5310 5.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -1.1930 3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 21 22 2 0 0 0 0 21 33 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END