IBS-ZINC06624652 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0300 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 2.1860 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 3.5870 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 4.4310 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7470 3.9180 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8350 4.7650 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 6.1410 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3440 6.6640 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2530 5.7990 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4770 8.1290 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 9.2490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2380 10.5050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5480 10.6820 -0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3780 9.6480 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8490 8.3650 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5590 7.2020 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9100 7.2590 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5610 6.2310 -0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5970 8.5630 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8490 9.7630 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4960 10.9890 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8770 11.0340 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6170 9.8620 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9910 8.6330 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 -0.6290 -0.0350 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.7590 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 3.1670 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 1.9270 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2380 1.9360 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9000 2.8490 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8340 4.3560 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 6.1960 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 9.1420 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 11.3750 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9240 11.9050 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3830 11.9880 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6960 9.9110 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5780 7.7270 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 28 2 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 29 45 1 0 0 0 0 M END