PUBCHEM-ZINC06193308 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 74 0 0 0 0 0 0 0 0999 V2000 -0.4810 -2.2510 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -1.9800 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -0.0510 -1.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 0.2500 -0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -0.1850 -2.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 1.2970 -2.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 1.5850 -3.9020 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 1.9130 -3.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9210 3.3860 -3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 4.3020 -4.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3220 5.7220 -3.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5770 6.6780 -4.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6990 8.0320 -4.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 8.4310 -3.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 7.4690 -2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 6.1250 -2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 5.1580 -1.4910 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8580 5.4340 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 3.8140 -1.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 3.0070 -0.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 9.7760 -2.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 10.2240 -1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 9.0390 -5.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 8.6760 -6.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 1.5180 -5.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 1.2900 -6.5360 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 1.6260 -5.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 1.3020 -6.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 0.6300 -6.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 0.3410 -7.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 1.6000 -8.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 2.2810 -8.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 2.5700 -7.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -1.6450 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -2.0410 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -3.3040 -0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 -2.2270 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -2.5620 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 0.8590 -2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -0.8360 -2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 1.0270 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 -0.6350 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 0.6100 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -0.8090 -2.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -0.4820 -3.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 1.5260 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 1.9680 -2.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 1.6430 -4.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 1.2900 -2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3090 4.0140 -5.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 6.3480 -5.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 7.7440 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6410 11.3120 -1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 9.8030 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 9.9980 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 9.5910 -7.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2690 8.2250 -7.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0320 8.0140 -6.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 2.0290 -4.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 0.5900 -7.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 1.2720 -5.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 -0.3050 -5.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 -0.0810 -7.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 -0.4170 -8.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 2.3010 -7.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 1.3450 -9.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 3.2160 -9.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 1.6380 -9.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 3.0110 -7.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 3.3270 -6.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -0.5040 -1.5910 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4640 0.0240 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 2 71 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 3 71 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 5 71 1 0 0 0 0 6 7 1 0 0 0 0 6 46 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 48 1 0 0 0 0 8 49 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 50 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 30 31 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 31 32 1 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 32 33 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 33 69 1 0 0 0 0 33 70 1 0 0 0 0 71 72 1 0 0 0 0 M CHG 1 71 1 M END