IBS-ZINC04000058 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 -0.1630 1.4190 -0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -0.0340 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -0.5960 -1.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -2.1980 -1.6080 P 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 -2.6940 -2.7960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -2.7620 -0.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6360 -2.7220 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -3.0980 1.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -2.5820 -1.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -2.2370 -2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 -2.8970 -2.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0640 -1.3780 -1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 -1.1660 0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2820 -2.2650 0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 -3.6360 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 -3.8810 -0.7450 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2240 -3.8130 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7020 -5.2580 -0.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3740 -6.2540 -1.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7990 -7.5140 -1.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5650 -7.7440 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -6.8160 -0.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 -5.6040 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 1.9720 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 1.5030 -1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 1.8930 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -0.1100 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -0.5760 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1470 -3.4290 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 -1.7150 -0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9270 -3.0820 1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 -2.4040 2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -4.0980 1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -1.1480 -2.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -2.5930 -3.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -2.4770 -3.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 -3.9650 -2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9690 -1.3430 -1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3590 -0.6170 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 -1.1400 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8630 -0.1930 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 -2.1150 2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2600 -2.2150 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 -3.7240 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3580 -4.4080 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3450 -6.0640 -2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 -8.2970 -2.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -8.7090 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -4.8980 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 -2.7350 -1.2420 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5490 -2.7540 -0.6910 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 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 50 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END