IBS-ZINC05478052 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 0.5130 -2.1390 0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -2.1700 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6230 -0.6180 -0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 -0.3560 -2.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 -0.3720 1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 1.1520 1.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5670 1.5420 3.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 1.8850 4.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 2.2420 5.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 2.2780 5.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3250 2.6220 6.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 3.0240 7.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0980 3.3070 8.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4230 3.1810 8.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7330 2.7730 7.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6670 2.5030 6.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6860 2.0970 4.8440 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5230 1.9280 4.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4080 1.9580 4.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9610 1.5560 3.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7070 1.2310 2.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 3.1890 8.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -3.1430 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -1.4770 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -1.8010 1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -2.5340 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 -2.8130 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2480 0.2310 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 -1.5290 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 0.5500 -2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -1.1870 -2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8320 -0.2130 -2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -0.8410 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 -0.7990 1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 1.5030 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 1.6600 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 1.8300 3.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 3.6320 9.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2270 3.4040 9.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7650 2.6770 6.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 4.0980 7.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 3.2620 9.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 2.3280 8.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -0.7670 0.1500 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7560 -0.1220 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 44 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 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 22 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 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END