IBS-ZINC05157828 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -4.0880 1.5840 1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2100 0.1600 1.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -0.5550 0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3600 0.1020 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -0.6240 -0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 -2.0040 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 -2.6660 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 -1.9390 0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 -4.0630 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 -4.6880 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7600 -4.0400 0.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -6.1620 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6050 -6.9080 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6540 -8.2840 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8690 -8.9320 0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0560 -8.1980 0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0140 -6.8090 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3580 -8.8950 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6940 -9.5970 1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0050 -10.2510 1.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5400 -10.7500 2.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7660 -11.3530 2.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4850 -11.4740 1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9750 -10.9900 0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7300 -10.3750 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2100 -9.9000 -0.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3510 -8.8600 -0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3940 -7.9240 -1.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8520 2.0310 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1000 1.8730 1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 1.9330 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3120 1.1800 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -0.1110 -1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 -2.5690 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1320 -2.4510 1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -4.5820 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6520 -6.4080 0.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 -8.8570 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9010 -10.0090 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9290 -6.2370 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0180 -9.6640 2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9860 -10.6590 3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1780 -11.7390 3.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4530 -11.9530 1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5420 -11.0900 -0.3920 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 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 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 41 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 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 M END