IBS-ZINC05034231 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -1.9980 1.1620 0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 -0.3180 0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -0.7790 1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 -2.2740 1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 -3.0220 1.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 -2.6300 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -1.1460 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6890 -4.3930 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 -4.9780 0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -6.3600 0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -7.2000 1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 -6.6920 2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 -5.2330 2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2760 -5.1040 3.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -6.1950 3.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 -7.1330 3.3040 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -8.6510 1.4100 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0200 -9.0950 2.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -9.3980 0.6990 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3690 -6.8930 -0.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -6.4800 -1.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 -5.6230 -2.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 -5.2170 -3.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 -5.6620 -4.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 -6.5150 -3.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -6.9210 -2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -7.9870 -1.9750 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 1.7500 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 1.4900 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 1.3020 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -0.4580 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -0.2220 1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -0.6010 2.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.4490 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -2.6080 2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 -2.8040 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -3.2230 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 -0.9740 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 -0.8510 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -4.3630 -0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -7.5520 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 -5.2760 -1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -4.5500 -3.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -5.3420 -5.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 -6.8610 -4.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 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 36 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END