ASINEX-ZINC04854682 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 0.3990 1.5330 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 0.0120 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -0.6180 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -2.1310 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -1.9240 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -0.4090 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -3.9710 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 -4.2190 1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -3.2880 2.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7770 -5.5270 1.7970 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9960 -6.1140 2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9820 -5.3690 2.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1760 -5.9660 3.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4090 -7.3190 3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4490 -8.0870 2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2500 -7.4910 2.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2680 -8.3480 1.3210 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.5410 -9.5450 1.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 -7.8170 0.9280 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4510 1.8330 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 1.9800 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 1.9570 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -0.3520 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -0.3750 1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -0.1910 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -2.6130 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -2.5410 2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -2.2040 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -2.3930 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 0.0260 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 -0.0170 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -4.3600 2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -4.4510 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1460 -6.1840 1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8600 -4.3110 3.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9270 -5.3670 3.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3380 -7.7740 3.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6550 -9.1430 2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -2.4770 1.1800 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2090 -2.0420 1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 39 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 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 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M CHG 1 39 1 M END