PUBCHEM-ZINC05138186 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 66 0 0 1 0 0 0 0 0999 V2000 0.4160 1.5740 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 0.0300 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -0.4850 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -0.5620 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 -0.2340 1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 -0.0740 2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4370 -0.5800 2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5260 -2.0390 2.4670 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 -2.7980 1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -2.2980 1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4580 -2.5710 3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0910 -1.8510 4.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6770 -4.0920 3.3790 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.5220 -4.5240 2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7610 -4.7060 4.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5520 -6.2670 4.8580 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.1660 -5.7720 4.1850 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.3120 -6.3750 3.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3050 -6.0240 5.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3700 -5.4480 6.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4550 -5.7100 7.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4530 -6.5460 6.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4360 -7.1220 5.5560 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3690 -6.8470 4.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -0.3730 -1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 0.0430 -1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0810 -0.2980 -2.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -1.0650 -3.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -1.4890 -3.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -1.1460 -2.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 2.0420 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 1.9700 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 1.9240 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -0.1770 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 -1.5790 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -0.1000 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 -0.2040 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -1.6520 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -0.6580 2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 0.8470 1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 0.9970 2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5930 -0.2710 3.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0710 -0.0710 3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8290 -0.3280 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6320 -3.8630 1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9870 -2.6820 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 -2.4930 2.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -2.7830 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7520 -4.8810 4.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6830 -4.0870 5.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5760 -4.7960 6.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5190 -5.2750 8.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3190 -6.7810 7.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4010 -7.3300 3.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 0.6480 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 0.0390 -3.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 -1.3310 -4.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -2.0880 -4.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -1.5060 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 -0.7920 1.4710 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.4820 -0.5930 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0830 -4.3650 3.7690 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3000 -3.7590 4.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 5 60 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 6 60 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 10 47 1 0 0 0 0 10 48 1 0 0 0 0 10 60 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 15 1 0 0 0 0 13 62 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 62 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 30 59 1 0 0 0 0 60 61 1 0 0 0 0 62 63 1 0 0 0 0 M CHG 1 60 1 M END