PUBCHEM-ZINC03870386 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 72 0 0 1 0 0 0 0 0999 V2000 -1.1940 4.0020 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 2.8080 -0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 2.9080 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 1.5100 -0.4850 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3620 0.6590 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 1.5060 0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 2.0660 0.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 0.8810 1.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 0.0730 1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -0.4610 3.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -0.3900 3.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1200 0.8990 3.1870 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8220 1.7820 3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 0.8650 3.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 0.2820 2.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4110 1.4820 3.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8670 1.4490 3.7490 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1620 0.4890 3.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5390 1.6330 5.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2110 0.4590 5.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5090 -0.4380 5.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6980 0.4040 7.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3380 -0.8870 8.2240 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.0310 -0.6160 9.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6620 -2.0220 7.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 -0.7770 8.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2930 2.5600 2.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4660 3.3020 2.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 1.4120 -1.6640 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 0.9030 -2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 0.5240 -2.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 0.8050 -4.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 1.2450 -3.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 1.1650 -5.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9700 0.6370 -6.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8000 0.5450 -7.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3070 0.0300 -8.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 -0.4100 -8.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -0.3360 -7.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 0.1910 -6.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7920 0.2870 -5.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 4.9270 -0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 3.9300 -1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 3.9980 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 2.8110 -1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 2.9710 1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 2.0260 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 3.8000 0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -0.7610 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 0.6920 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -1.4890 3.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 0.1790 4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 -1.2630 3.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -0.2850 4.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0190 1.9480 4.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1750 2.5500 5.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6190 1.6980 4.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2600 1.1210 7.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3040 0.1730 8.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 -1.5980 9.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0380 -0.8380 7.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3370 2.6920 2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 1.7150 -1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0060 1.6510 -3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4730 1.5070 -4.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8260 0.8800 -7.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9490 -0.0400 -9.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 -0.8150 -9.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -0.6810 -7.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -0.0460 -5.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 45 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 3 48 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 29 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 12 1 0 0 0 0 9 10 1 0 0 0 0 9 49 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 51 1 0 0 0 0 10 52 1 0 0 0 0 11 12 1 0 0 0 0 11 53 1 0 0 0 0 11 54 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 27 1 0 0 0 0 19 20 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 58 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 27 28 2 0 0 0 0 27 62 1 0 0 0 0 29 30 1 0 0 0 0 29 63 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 41 2 0 0 0 0 33 34 2 0 0 0 0 33 64 1 0 0 0 0 34 35 1 0 0 0 0 34 65 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 36 66 1 0 0 0 0 37 38 1 0 0 0 0 37 67 1 0 0 0 0 38 39 2 0 0 0 0 38 68 1 0 0 0 0 39 40 1 0 0 0 0 39 69 1 0 0 0 0 40 41 1 0 0 0 0 41 70 1 0 0 0 0 M END