PUBCHEM-ZINC03678546 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 0.8270 0.1590 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -1.0740 -0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -1.0030 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -0.4560 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5730 -0.3640 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 -0.8220 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 -1.3890 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 -1.4550 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9560 -1.8530 2.3980 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0380 -2.0070 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3930 -3.1300 2.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -3.3720 4.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -4.7150 4.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -5.5240 5.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -6.8480 5.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 -7.3680 3.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 -6.5840 2.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 -5.2630 3.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2040 -4.2840 2.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4010 -4.4160 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1360 -2.3300 5.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1140 -1.2140 4.8820 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1550 -1.5580 4.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0120 -0.0180 5.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 1.1110 5.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 -0.3740 7.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1980 0.7010 8.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4910 -0.7410 0.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3630 -0.3020 -0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 0.0810 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 1.0700 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 0.2750 1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -1.1860 -1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -1.9730 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 -0.0880 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1630 0.0840 -1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -1.8670 1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 -5.1320 6.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -7.4750 5.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -8.3990 3.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -6.9930 1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4790 -2.7840 6.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 -1.9090 5.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9490 1.4620 7.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4110 0.2960 9.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1940 1.1360 8.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1680 0.7440 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2900 -0.9500 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3880 -0.3670 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 -0.7760 3.4440 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8390 -0.4140 3.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3920 0.0280 3.1890 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 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 50 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 50 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 M CHG 1 50 1 M END