PUBCHEM-ZINC03687169 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 0 0 0 0 0 0999 V2000 -0.3940 1.5780 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 0.0780 -0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -0.5640 0.1150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 -1.9320 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 -2.7510 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -4.1380 -0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -4.7250 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8200 -3.9090 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 -2.5170 0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6720 -1.6520 0.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0130 -2.1350 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9440 -0.9500 0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -6.1770 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -7.1260 0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8010 -8.4070 0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 -9.7220 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -10.7760 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1390 -10.5470 -0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3790 -9.2490 -1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 -8.2030 -0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7130 -6.8460 -0.8930 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2690 -6.3990 -1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3360 -9.0590 -2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 -12.3850 0.8060 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -6.8590 1.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -6.3750 3.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -5.9500 4.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -5.4480 5.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 2.1210 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 1.8950 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 1.8610 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.1780 -1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -0.2120 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -2.3420 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -4.7600 -0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 -4.3820 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2160 -2.6030 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1870 -2.8550 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9900 -1.2670 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7530 -0.4550 1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7770 -0.2030 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -9.9120 1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 -11.3900 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3360 -9.3980 -2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 -8.0100 -2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 -9.6350 -3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -7.7660 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -6.1130 1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -5.5270 2.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 -7.1720 3.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -6.7980 4.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -5.1600 3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -4.5880 5.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -6.2370 5.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -4.9970 6.4860 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2020 -4.6900 7.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -4.2050 6.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -5.7510 6.7360 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 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 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 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 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 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 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 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 55 57 1 0 0 0 0 55 58 1 0 0 0 0 M CHG 1 55 1 M END