PUBCHEM-ZINC03717058 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 -0.2160 0.9390 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 -0.4690 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -0.9360 1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 -0.1400 2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -0.6890 3.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 -2.0610 3.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -2.8620 2.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 -2.3110 1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -3.0160 -0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -4.4260 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -5.0160 -1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -6.0510 -2.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -6.6280 -3.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -6.1830 -3.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 -5.1640 -2.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -4.5870 -1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 0.2230 4.2580 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8210 1.1710 4.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 0.4860 3.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 1.6750 3.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6530 1.6990 3.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4090 0.3100 3.7070 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9110 -0.3340 4.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -0.6140 5.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -1.5100 7.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -0.9210 8.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 0.0680 8.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6250 0.7180 6.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 1.4180 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 1.1240 -1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8120 1.3730 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 0.9210 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 -2.5370 3.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.9140 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 -4.6190 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 -4.9080 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 -6.4200 -1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -7.4260 -3.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -6.6340 -4.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 -4.8180 -2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8270 -3.7940 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 2.4760 2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2440 2.4670 2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 -1.2980 4.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -1.1450 5.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 0.3330 5.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -1.7250 7.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -2.4770 6.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 0.1180 8.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -1.5260 9.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 -0.3990 7.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 0.8350 8.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8010 1.4050 6.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 1.3170 6.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -0.2920 5.7010 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6630 -1.1610 5.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -0.9990 8.6260 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5160 -0.9830 9.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 -1.9350 8.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 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 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 55 1 0 0 0 0 19 20 1 0 0 0 0 19 23 2 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 57 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 55 56 1 0 0 0 0 57 58 1 0 0 0 0 57 59 1 0 0 0 0 M CHG 1 55 1 M CHG 1 57 1 M END