PUBCHEM-ZINC02685302 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 0 0 0 0 0999 V2000 -0.0340 1.3040 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 -0.0460 0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -0.2920 -0.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -0.9790 1.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -2.1960 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -2.7810 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -3.9820 -0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -4.6070 -0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -4.0280 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 -2.8240 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 -4.6610 -0.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8260 -6.0060 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8110 -6.6700 -0.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1690 -6.6850 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9370 -8.4840 -0.1000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 -8.9400 -1.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3400 -8.8920 1.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5710 -9.1380 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0660 -9.8850 -1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3480 -10.3980 -1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1360 -10.1640 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6410 -9.4170 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3570 -8.9080 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8260 -8.1130 2.2180 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.5180 -7.9100 3.2000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6960 -7.6610 2.1670 O 0 5 0 0 0 0 0 0 0 0 0 0 -10.5090 -10.7120 0.1560 N 0 3 0 0 0 0 0 0 0 0 0 0 -10.9460 -11.3700 -0.7720 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2040 -10.5060 1.1350 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6990 1.9190 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 1.7900 1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 1.1780 2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -0.8070 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -2.2950 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -4.4340 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -5.5460 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2040 -2.3730 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5630 -4.1310 -0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6910 -6.3730 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7590 -6.4080 -1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4500 -10.0680 -1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7350 -10.9810 -1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2570 -9.2340 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 33 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 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 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 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 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 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M CHG 1 27 1 M CHG 1 29 -1 M END