PUBCHEM-ZINC03086171 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 -0.1940 1.6940 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 0.2060 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -0.4600 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -1.8110 1.2270 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -2.6740 0.1130 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9840 -2.8180 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -3.8190 0.9190 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0900 -4.6490 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -2.7660 2.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -2.7600 3.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 -4.2900 0.4210 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -5.5480 0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 -6.3740 1.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9740 -5.7930 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 -7.1450 0.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5830 -7.5150 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9090 -8.8610 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1180 -9.3760 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0100 -8.5450 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6930 -7.2020 -1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4810 -6.6860 -0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -2.0510 -1.3540 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -0.4460 -1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 0.3240 2.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 0.9790 2.7530 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3730 2.1570 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 2.1970 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 1.8950 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 -3.6540 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 -5.5570 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 -5.1180 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2130 -9.5100 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3610 -10.4230 -0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9520 -8.9420 -1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3900 -6.5550 -1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -5.6350 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5790 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 0.2050 -2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 0.2380 3.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 29 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 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 2 0 0 0 0 M CHG 1 25 -1 M END