PUBCHEM-ZINC06678389 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 0.1490 1.0850 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.3330 0.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -0.9400 -0.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -2.3140 -1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -2.9290 -2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -2.1770 -3.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -0.8080 -2.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -0.1870 -1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 -2.8500 -4.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -2.8950 -5.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -3.5680 -6.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 -3.9730 -6.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -3.7210 -7.7590 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -4.2460 -8.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -5.0300 -9.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -5.5480 -10.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 -5.2840 -11.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 -4.4960 -10.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4130 -3.9760 -9.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 -5.8390 -12.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3070 -5.6670 -12.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5450 -6.3420 -13.8280 N 0 3 0 0 0 0 0 0 0 0 0 0 6.5980 -6.5490 -14.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3730 -7.2950 -15.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6870 -7.7970 -15.7110 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 -6.9180 -14.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 -6.6360 -13.2860 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -6.9370 -13.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 1.3340 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 1.5600 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 1.4410 1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -2.9020 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -3.9990 -2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -0.2220 -3.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 0.8830 -1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 -2.2900 -4.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 -3.8660 -3.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -3.4550 -5.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -1.8790 -5.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -3.4680 -7.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -5.2340 -9.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -6.1580 -11.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0940 -4.2900 -10.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9620 -3.3620 -8.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 -5.0950 -12.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5710 -6.1270 -14.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1040 -7.5540 -16.4690 H 0 0 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 26 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 22 1 M END