PUBCHEM-ZINC06015129 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 0.1590 1.7150 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 0.1860 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3430 -0.2820 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -0.3260 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 0.0190 -1.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9870 -0.3340 -2.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -1.1840 -3.4880 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 -0.0160 -2.1450 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8410 0.8030 -1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3060 -0.0920 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6080 -0.5700 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9910 -1.3900 1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 -1.7020 2.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 -1.2290 2.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 -0.4420 1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1750 -0.4900 -3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2800 0.5670 -4.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.4890 -5.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 1.4970 -6.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 1.4790 -7.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0020 2.4700 -8.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 3.5100 -8.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6870 3.5520 -7.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5560 2.5460 -6.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2920 2.5690 -5.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7540 1.1870 -3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1720 1.6330 -4.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9360 1.7000 -3.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 4.3540 -9.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 4.0560 -10.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 2.6760 -9.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 2.0480 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 2.1070 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 2.0790 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -0.2070 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 0.1100 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 -1.3710 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 0.0830 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -1.4090 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 0.1360 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 0.5010 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6840 1.3860 -1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0680 1.4770 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3060 -0.3090 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9970 -1.7800 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3600 -2.3400 2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 -0.0700 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 -0.6960 -2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 -1.4030 -3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8030 -0.3250 -5.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 0.6830 -7.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3920 4.3560 -6.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 4.6890 -9.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 4.1810 -11.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 27 2 0 0 0 0 18 19 2 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 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 31 1 0 0 0 0 22 23 2 0 0 0 0 22 29 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END