PUBCHEM-ZINC03874207 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 0.2150 1.7030 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 0.1780 0.2300 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8310 -0.1520 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -0.4720 1.3070 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1540 0.1370 2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 -0.4820 0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -0.3910 -0.7610 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 -0.3230 -1.0760 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5400 -1.3520 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 0.5300 -2.3410 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0020 1.5600 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -0.0160 -3.5260 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2530 -1.0690 -3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 0.7840 -4.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 0.0430 -3.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -0.1740 -2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 0.4890 -2.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -0.6500 -3.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 -0.5040 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 -0.4910 2.5130 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5190 -2.1710 1.6870 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -2.4770 3.3160 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3770 -2.5490 3.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -3.8080 3.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -3.6290 5.3930 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1470 -3.6690 5.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -1.4660 4.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 -4.6280 6.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -4.2650 6.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -5.9640 6.2710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -6.9510 7.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 -6.4800 5.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 2.1290 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 2.1880 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 1.9710 1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 1.8390 -4.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 0.4150 -5.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 0.7190 -5.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 -3.9840 3.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -4.6500 3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 -0.8540 4.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -0.7940 4.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -6.5270 7.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -7.7540 6.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -7.3620 7.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 -7.1320 6.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 -7.0630 4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -5.6950 5.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 1.6180 -2.7860 O 0 5 0 0 0 0 0 0 0 0 0 0 4.7750 -0.5150 0.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -2.2480 5.6120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 -1.8560 6.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 21 1 0 0 0 0 6 7 2 0 0 0 0 6 19 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 2 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 27 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 25 51 1 0 0 0 0 27 41 1 0 0 0 0 27 42 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 43 1 0 0 0 0 31 44 1 0 0 0 0 31 45 1 0 0 0 0 32 46 1 0 0 0 0 32 47 1 0 0 0 0 32 48 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 20 -1 M CHG 1 49 -1 M END