PUBCHEM-ZINC06088396 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 1 0 0 0 0 0999 V2000 -1.7520 -6.6640 -8.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -5.6610 -7.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 -4.3940 -7.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 -3.5020 -6.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -3.8850 -5.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 -5.1040 -5.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -5.9820 -5.9930 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -5.4710 -3.8590 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -4.5580 -2.4850 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -5.2070 -1.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -3.2080 -2.8760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -4.6710 -1.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -5.6730 -1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6980 -5.7650 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6350 -4.8480 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 -3.8420 -2.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 -3.7530 -2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -4.9380 -0.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2610 -5.2130 0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2920 -5.2590 1.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6870 -5.4600 1.0330 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.7400 -5.6720 2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5590 -4.2730 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4450 -4.6860 -0.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3280 -6.0410 -0.4330 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2900 -6.5980 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9210 -7.7530 0.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1670 -6.7310 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1580 -6.2090 -1.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.8830 -7.0100 -2.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0030 -6.6840 -3.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6180 -7.6440 -4.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1500 -8.9510 -4.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0590 -9.2920 -3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4220 -8.3300 -2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0250 -8.4400 -1.6800 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.4090 -2.8660 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4030 -2.0540 0.6470 F 0 0 0 0 0 0 0 0 0 0 0 0 -8.5340 -2.8700 2.5960 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.1490 -2.3700 0.8480 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 -6.5660 -8.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -7.6710 -7.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 -6.4790 -8.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 -4.1070 -8.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 -2.5070 -6.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -6.2630 -3.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -6.3860 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9980 -6.5490 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9720 -3.1270 -2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 -2.9680 -3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6840 -4.8080 -1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5050 -5.5710 2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -4.9840 1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3790 -5.6710 -3.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4740 -7.3820 -4.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6420 -9.6990 -4.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6960 -10.3100 -3.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 45 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 46 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 2 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 2 0 0 0 0 28 29 2 0 0 0 0 28 36 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 33 34 2 0 0 0 0 33 56 1 0 0 0 0 34 35 1 0 0 0 0 34 57 1 0 0 0 0 35 36 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 37 40 1 0 0 0 0 M END