IBS-ZINC04516834 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 0.5040 0.6480 -1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.6140 -0.8910 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1190 -1.4000 -1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -1.0770 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -2.2890 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -1.9550 1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -1.3940 0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -1.7630 0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -1.2880 0.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4220 -1.7290 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8870 -2.8680 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2330 -3.2650 0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1510 -2.5280 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6870 -1.3910 -0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3520 -0.9920 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5650 -0.6400 -1.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6030 -2.9050 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2840 -2.1040 -0.8740 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3230 -0.3920 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 0.5060 -0.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 0.4810 -2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 0.9500 -2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 1.4870 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 -1.3340 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -0.2630 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -3.1280 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -2.6080 1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -2.8580 2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -1.2160 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 -2.5090 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8530 -0.4870 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2140 -3.4820 1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5620 -4.1540 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0480 -0.1000 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4620 -1.1130 -1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0200 -3.9330 0.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 2 0 0 0 0 19 20 2 0 0 0 0 M CHG 1 18 -1 M END