IBS-ZINC00525480 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.1110 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 -0.5120 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6590 -1.9060 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 -2.6690 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -2.0190 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -4.0030 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -4.7420 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2030 -4.1340 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7730 -2.8630 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1120 -2.7320 0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8910 -3.7750 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3980 -5.0390 0.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0650 -5.2540 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 -6.3880 0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3180 -6.1790 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6540 -6.5700 -1.3970 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7410 -6.8330 -1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6280 -7.7640 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8630 -7.2420 -2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2680 -6.0540 -2.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3100 -5.4760 -2.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 1.1900 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4970 0.0740 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 -2.5920 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9620 -3.6300 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8490 -7.0230 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2340 -5.9050 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1850 -8.6140 -1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9030 -8.0370 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2530 -8.0060 -2.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6360 -6.9000 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7690 -6.4090 -3.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0450 -5.3310 -3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END