PUBCHEM-ZINC05858948 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 -1.0960 0.5980 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -0.9120 0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -1.6450 1.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6350 -1.2660 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -0.6600 -1.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -1.3240 -2.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 -2.4440 -2.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 -0.6090 -3.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8910 -1.0370 -4.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 -2.2860 -4.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 -3.1690 -5.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 -4.3390 -6.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 -4.6450 -5.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 -3.7730 -4.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -2.5970 -4.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 -4.1060 -3.7800 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3210 -3.3420 -2.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -5.1430 -4.0150 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.6750 0.9450 -2.8360 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 0.5670 -1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 1.5790 0.2050 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 0.8500 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 1.1200 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 0.8990 1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -1.2140 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 -1.3440 2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -2.7210 1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -1.3930 2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 -2.3480 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3320 -0.8850 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 -0.4600 -5.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5530 -2.9320 -6.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -5.0200 -6.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -1.9180 -3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -5.8000 -5.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -5.7200 -6.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 35 36 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END