PUBCHEM-ZINC01855912 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.5850 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 1.7950 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 2.2560 -2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 2.4880 -3.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 2.2560 -3.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 1.8230 -2.3220 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6970 2.9880 -4.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 4.7980 -4.6940 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 5.0920 -6.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 4.1620 -6.8690 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7350 6.5080 -6.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2590 2.4980 -2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5880 4.2040 -1.7670 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.2990 4.2080 -1.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8960 3.2050 -2.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0630 5.4590 -1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7990 1.5530 -0.0090 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.4370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 2.4340 -4.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 2.6240 -5.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7240 2.6240 -4.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 7.2020 -5.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 6.6720 -7.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8060 6.6720 -6.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 2.3300 -3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 1.8120 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3620 6.2500 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6570 5.7750 -2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7220 5.2570 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 1.6720 -2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 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 18 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 M CHG 1 7 1 M CHG 1 18 -1 M END