IFLAB-ZINC04570775 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 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 0.0230 -0.6990 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0790 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0660 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.2510 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -5.0010 -1.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -6.3010 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -6.7080 0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -5.2810 1.4080 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -7.2740 -2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 -6.9870 -2.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -7.9320 -4.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -7.8680 -5.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9510 -7.0280 -4.9370 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -8.8410 -6.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 -8.5730 -7.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3410 -9.3660 -8.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4020 -9.1620 -8.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 -9.9700 -10.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 -10.9820 -10.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 -11.1880 -9.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 -10.3780 -8.3680 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 0.0250 -0.1610 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6200 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5970 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1380 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -7.7340 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -7.1640 -2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -8.2910 -1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 -7.0960 -2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -5.9690 -3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -8.6040 -4.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -8.7310 -6.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -9.8580 -5.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1130 -8.3720 -8.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3750 -9.8110 -10.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7550 -11.6120 -11.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 -11.9790 -9.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -10.5370 -7.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 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 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 M END