ASINEX-ZINC02099978 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -1.9560 -1.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -2.6160 -2.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -2.0000 -3.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 -4.0880 -2.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -4.8080 -1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -6.1890 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 -6.8020 -2.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -6.0920 -3.1620 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1930 -4.7820 -3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -6.9320 -0.0470 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7110 -0.4890 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -0.6340 2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -0.3610 2.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 -1.1230 3.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -1.4350 3.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7530 -1.8910 4.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -2.0210 5.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -1.7180 5.8340 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0940 -1.2770 4.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0750 -2.2070 4.6310 O 0 5 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 0.1430 -0.2120 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -0.0490 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -2.4480 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -4.3040 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -7.8760 -2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 -4.2380 -4.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -6.5500 -3.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -0.7070 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -1.3240 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 -2.3750 6.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -1.0350 4.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -1.8200 6.6640 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 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 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 34 1 0 0 0 0 13 33 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 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 36 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 38 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M CHG 1 22 1 M CHG 1 24 -1 M END