PUBCHEM-ZINC06570320 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 0.2340 2.3810 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 0.9230 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 0.0330 -1.0030 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2810 0.1530 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -1.4230 -0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 0.4710 -2.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 0.2780 -3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -0.4000 -3.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -0.5340 -5.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 0.0130 -6.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 0.7050 -5.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 0.8240 -4.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 1.2920 -6.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 1.3240 -6.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 1.8460 -7.8550 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 2.2730 -9.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0650 2.0030 -9.5630 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 2.9840 -9.7980 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 3.2110 -11.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 2.3440 -12.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 2.5300 -13.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 3.5620 -13.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 4.4330 -13.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 4.2860 -11.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 5.2820 -10.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 5.4760 -13.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 5.6820 -12.9130 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3050 2.4830 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 2.8070 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 2.9760 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 0.5610 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 0.8740 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -2.0800 -1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -1.7730 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -1.5440 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -0.8550 -3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -1.0810 -5.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -0.1420 -7.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 1.3450 -4.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 1.9410 -7.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 3.4400 -9.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 1.4770 -11.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 1.8510 -14.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 3.6860 -15.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 4.9410 -10.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 6.2780 -11.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 5.4300 -9.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 6.0440 -14.6510 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 2 0 0 0 0 M CHG 1 27 -1 M END