ASINEX-ZINC04968465 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0600 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -2.0830 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -2.8450 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -4.1590 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 -4.5000 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -3.0790 -0.0250 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 -5.1610 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -6.3460 -0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3100 -4.7640 0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3280 -5.7100 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1760 -7.0030 0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2170 -7.7140 0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3620 -7.1130 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0610 -5.3740 0.0480 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.7140 -7.7790 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8420 -8.6580 1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8090 -6.7110 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8640 -8.6460 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -0.2200 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 -5.5090 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5260 -3.8180 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7350 -8.0400 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8190 -9.1400 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0620 -9.4190 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7180 -6.0850 -0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7870 -7.1930 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7020 -6.0940 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0840 -9.4070 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8410 -9.1280 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7730 -8.0200 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 27 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 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 19 28 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 M END