IBS-ZINC05163598 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.4540 -0.5510 1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -0.0410 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -0.4060 -1.2160 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6530 0.0330 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -1.9280 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -2.2900 -2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -1.6960 -3.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -0.1810 -3.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2190 1.5530 -2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 1.9730 -3.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 1.1530 -4.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 3.3270 -3.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 4.3700 -2.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7990 5.5060 -3.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6780 6.3730 -2.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 5.2690 -4.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 3.9040 -4.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 3.3800 -5.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0250 4.2100 -6.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 5.5600 -6.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 6.0890 -4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -1.6410 1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -0.1670 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1150 -0.2090 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -0.5010 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 1.0420 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -2.3120 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -2.3700 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -1.8810 -2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -3.3740 -2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -1.9140 -4.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.1340 -3.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 0.2580 -3.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 0.2430 -4.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 2.1030 -2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 1.7680 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 4.2890 -1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 2.3290 -5.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5810 3.8060 -7.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7450 6.2010 -6.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 7.1420 -4.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 0.1120 -2.4430 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 42 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 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 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 M END