PUBCHEM-ZINC05892423 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 0.7290 -0.4790 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0070 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -0.5280 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 0.2220 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7150 -0.2520 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 -1.4830 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9940 -2.2330 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7000 -1.7510 -0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3190 -1.9660 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0960 -2.1240 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5200 -1.6160 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1700 -2.4610 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2540 -2.5520 1.3030 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.9560 -2.3270 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3800 -2.4980 2.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4410 -2.3880 2.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3620 -2.8480 3.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5540 -2.8730 2.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8120 -3.2240 3.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8700 -3.2720 2.6360 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7240 -3.4920 4.5650 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5620 -3.4400 5.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5740 -3.6960 6.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3700 -3.1420 4.6600 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1360 -3.1080 5.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9420 -3.8500 5.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1310 -5.3450 5.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3310 -6.0390 4.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3190 -5.9730 5.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 -0.1030 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -0.1020 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -1.5690 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 1.0820 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -0.3850 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 1.1790 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 0.3340 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2180 -3.1910 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -2.3320 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6360 -1.5390 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1260 -3.1760 -1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4820 -0.5740 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1070 -1.6960 -1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1020 -1.9920 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3760 -3.4600 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9950 -2.1090 5.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2060 -3.8300 6.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 -3.3610 4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8530 -3.5240 6.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8000 -3.3620 4.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9240 -5.1950 6.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9200 -6.5080 5.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9730 -6.6700 6.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 M CHG 1 13 1 M END