PUBCHEM-ZINC03875878 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 2.9930 -0.5030 6.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -1.2290 5.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 -1.8650 4.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -1.1710 4.6780 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -1.7930 3.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 -2.9580 3.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 -3.5800 1.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -2.9980 0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -1.8090 1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -1.2280 2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 0.2590 2.9840 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 -0.1300 3.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 1.0480 3.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -3.6170 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -4.7650 -0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -5.3580 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 -4.7720 1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 -5.3430 2.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 -6.5120 -0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -7.5630 0.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -7.4930 1.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5090 -7.9960 3.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -7.9220 4.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -7.3510 4.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -6.8510 3.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -6.9120 1.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -7.2620 5.8200 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -7.2900 5.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -8.2040 6.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -5.7670 6.4660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -5.5240 -2.1380 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -4.8640 -3.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -6.9270 -1.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0300 -0.6640 6.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8170 0.5640 6.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -0.8820 7.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -0.6990 5.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -3.3910 3.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 -1.3580 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -3.1760 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -5.9080 3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 -8.4420 3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 -8.3100 5.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -6.4070 3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -6.5170 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -5.1390 5.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -5.5190 7.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 1.0110 1.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -5.1870 -2.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -5.5590 -3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 1.8510 1.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 17 2 0 0 0 0 8 9 1 0 0 0 0 8 14 2 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 48 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 46 1 0 0 0 0 30 47 1 0 0 0 0 31 32 2 0 0 0 0 31 33 2 0 0 0 0 31 49 1 0 0 0 0 48 51 1 0 0 0 0 49 50 1 0 0 0 0 M END