IBS-ZINC02133534 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -1.2130 2.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -0.1610 1.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -0.6470 2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1630 -0.1170 2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 -0.6160 3.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 -1.3230 4.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 -1.2870 -1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -1.5690 -1.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1870 -1.7840 -0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7020 -2.5900 -1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0070 -3.0290 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8030 -2.6750 -0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3040 -1.8770 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 -1.4250 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 -0.6230 1.1150 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 -0.3670 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 -0.2000 1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 0.4970 1.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 0.4060 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -0.2950 3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 -1.7360 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 -0.4680 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 0.9730 2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -2.8670 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 -3.6540 -2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8230 -3.0260 -0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9320 -1.6060 1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1740 -0.2760 4.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5990 -0.6200 4.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 36 37 1 0 0 0 0 M END