PUBCHEM-ZINC03874214 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -1.3200 0.4070 -0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -0.0980 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -0.7130 1.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3780 -0.4600 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -2.1450 0.8160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -2.7060 -0.3650 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3820 -2.7840 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 -1.5240 -1.6110 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -3.9910 -0.0420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4460 -4.1360 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -3.2980 1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -3.6200 2.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -5.2470 0.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -5.7550 -1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -5.2020 -2.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 -7.0650 -0.7680 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0950 -7.6780 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0310 -6.7590 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 -7.1150 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4230 -6.8070 1.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4370 -6.1400 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2590 -5.7840 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 -6.0920 -0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -7.8170 -2.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -8.3560 -2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 -0.2490 1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 0.6460 2.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 1.0260 -0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 1.2490 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 0.7600 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -0.3670 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -5.7410 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 -7.6330 1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5670 -7.0890 2.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3700 -5.9020 1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0520 -5.2710 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -5.8110 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -8.2800 -2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -8.9330 -3.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 1.8650 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 0.6940 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 1.4210 -1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 -0.7740 1.1770 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 26 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 24 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 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 28 42 1 0 0 0 0 M CHG 1 43 -1 M END