PUBCHEM-ZINC00627579 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 0.2330 1.6210 0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 0.2960 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -0.7050 0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -0.2780 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0910 -0.4480 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 -0.9740 -0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9170 -1.3410 0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 -1.1770 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -0.6510 1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 -1.8600 0.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9600 -2.2460 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6200 -2.1130 2.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3220 -2.8080 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5800 -3.5180 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8620 -3.9990 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8850 -3.7840 0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6310 -3.1030 1.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3510 -2.6180 2.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0450 -1.9580 3.2970 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9070 -1.5360 4.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1300 -1.6430 4.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1520 -0.7940 5.4250 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.2240 -1.3570 5.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7490 0.6080 4.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9370 1.5650 4.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6560 1.6610 6.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0790 0.2930 6.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9090 -0.6980 6.7670 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.1890 -0.2960 7.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2980 -2.0690 7.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6420 -3.0550 6.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 2.0630 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 2.3420 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 1.4910 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 0.5100 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -0.3060 0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -0.9310 1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -1.6490 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 -0.1690 -2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9650 -1.0860 -1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 -1.4490 2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -0.5360 2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6730 -1.9300 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7970 -3.7340 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0630 -4.5480 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8850 -4.1610 0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4520 -2.9870 2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0420 -1.7840 3.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9970 1.0230 5.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2750 0.5560 3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5880 2.5600 4.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6410 1.2330 4.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9950 2.1410 6.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5370 2.3060 6.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4990 0.4270 7.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8960 -0.1020 6.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1790 -2.0440 8.2710 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 13 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 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 48 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 24 1 0 0 0 0 22 28 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 M CHG 1 57 -1 M END