PUBCHEM-ZINC00461369 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3820 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 -0.6340 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 0.0460 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 1.3700 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 2.0610 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 -0.6450 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6430 0.2810 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9390 -0.5120 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.5690 0.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 -2.4530 0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5830 -1.5830 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3480 -1.7600 1.7270 S 0 0 0 0 0 0 0 0 0 0 0 0 7.3370 -3.1100 2.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4290 -1.1890 1.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1240 -0.7610 3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5140 -1.2890 4.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 -0.5050 5.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7740 0.8070 5.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3860 1.3350 4.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5650 0.5490 3.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5860 1.6470 6.6150 N 0 3 0 0 0 0 0 0 0 0 0 0 6.0470 1.1820 7.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9700 2.8030 6.6180 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9530 1.9210 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -0.5630 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 3.1410 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5260 0.9960 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 0.8130 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9450 -0.9620 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7960 0.1530 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 -3.0880 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 -3.0700 1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6390 -1.0250 2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -2.2190 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1730 -2.3140 4.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8610 -0.9170 6.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7260 2.3600 4.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0460 0.9600 2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 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 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END