CHEMDIV-ZINC04279658 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 -0.7560 -1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 -0.5840 -2.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 -1.2790 -0.7480 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6300 -2.2670 -1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 -0.2390 -1.1520 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0390 0.7250 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3590 -0.1530 0.0600 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4030 -0.2510 1.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 -1.2650 0.8040 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6460 -2.2440 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -0.7730 1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 -0.6350 2.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0520 1.0600 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8680 1.9340 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5540 3.1320 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4250 3.4620 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6120 2.5930 -0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9230 1.3960 -0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2860 4.9680 0.2210 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.2950 -0.7230 -2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9970 -0.2580 -3.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7250 -0.7020 -4.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7500 -1.6110 -4.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0480 -2.0770 -3.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3170 -1.6360 -2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1880 1.6770 1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4110 3.8120 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2930 2.8520 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0650 0.7210 -1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1960 0.4530 -3.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4920 -0.3380 -5.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3200 -1.9580 -5.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8490 -2.7870 -3.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5470 -2.0030 -1.1700 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 3 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 40 1 0 0 0 0 27 28 1 0 0 0 0 27 41 1 0 0 0 0 28 42 1 0 0 0 0 M END