PUBCHEM-ZINC06691914 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 0.1660 1.6660 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 0.1480 -0.1600 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7430 -0.1130 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 -0.4960 -0.4980 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3100 -1.1910 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 0.5980 -0.8150 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2810 0.9180 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 1.9920 0.2320 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 0.1770 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 1.2160 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3310 0.7100 -1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3360 1.7360 -1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7680 1.2430 -1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0720 0.1440 -0.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6900 2.1640 -1.8990 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1060 1.8680 -1.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9460 3.0580 -2.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4270 2.7160 -2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -1.3080 0.6690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -1.2970 1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -1.9150 2.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -0.4700 1.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 2.1500 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 2.0880 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 -0.0270 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0530 -0.7650 -1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6740 1.4360 -2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7910 2.1540 -0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 0.4810 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4410 -0.2290 -1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1320 1.9610 -2.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2500 2.6700 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3610 3.0510 -2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3720 1.5720 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2770 1.0040 -2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6570 3.3500 -3.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7370 3.9210 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7600 2.4740 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6790 1.8950 -2.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -1.8530 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -0.3400 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2160 3.8930 -2.7170 N 0 3 0 0 0 0 0 0 0 0 0 0 15.2240 3.6900 -2.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0580 4.7090 -2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9840 4.1710 -3.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 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 22 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 19 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 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 41 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 M CHG 1 42 1 M END