PUBCHEM-ZINC00990397 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3750 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -0.6820 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 0.0420 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 1.4200 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0860 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 2.3360 -0.0130 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 3.6060 0.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 1.4710 0.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 2.6080 -1.5970 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4230 3.4460 -2.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1650 3.8370 -3.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 3.1500 -4.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 3.8720 -5.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4350 4.9580 -5.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 4.9340 -3.8380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.1600 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -2.7480 -0.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -2.8560 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -4.2490 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -4.9780 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -6.3540 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -7.0070 -0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -6.2850 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -4.9090 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -6.9880 -1.6610 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9190 -8.2020 -1.7580 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -6.3530 -2.1700 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9010 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 -0.4770 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.1660 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0870 2.2120 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 2.8890 -2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1420 4.3430 -1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6570 2.2240 -5.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2200 3.6040 -6.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0850 5.7200 -5.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -2.3900 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9370 -4.4680 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -6.9210 0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -8.0830 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 -4.3460 -1.2580 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END