CHEMDIV-ZINC04564876 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 0 0 0 0 0999 V2000 0.9960 0.0210 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.9710 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -2.8200 0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 -3.4660 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -2.4930 0.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3020 -1.1860 -0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -0.5610 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7930 -2.9310 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6400 -2.2330 1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 -1.1080 2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0970 -0.4410 3.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3990 -0.8880 3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8250 -2.0120 2.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9620 -2.7120 1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3560 -3.8690 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4410 -4.5220 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7030 -4.4540 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0450 -4.8860 2.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4300 -4.4300 -0.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.7350 -4.9340 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2830 -4.7980 -1.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5710 -5.2690 -1.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3380 -5.8870 -0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7880 -6.0220 0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4980 -5.5520 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6800 -6.7750 1.7100 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -14.6040 -6.3790 -1.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.1830 -6.2440 -2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 0.3420 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 -0.4250 -1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 0.9180 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.8060 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -0.5150 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -2.5280 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -3.5070 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2970 -3.8750 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6670 -4.3070 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 -1.3200 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1210 -0.4840 -0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 0.3210 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 -0.2810 1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 -0.7490 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7490 0.4200 3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0830 -0.3780 3.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8480 -2.3500 2.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6870 -5.4460 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9930 -4.0010 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7190 -4.3220 -2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9400 -5.1350 -2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1170 -5.6810 1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6050 -6.7940 -3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1850 -6.6830 -2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2910 -5.1900 -2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -1.5500 -0.0410 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7760 -1.8250 -1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1870 -4.0780 -0.0240 N 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 32 1 0 0 0 0 2 33 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 54 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 7 54 1 0 0 0 0 8 9 1 0 0 0 0 8 56 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 46 1 0 0 0 0 16 56 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 50 1 0 0 0 0 27 28 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END