ASINEX-ZINC00864158 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 1.4250 -2.1080 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -2.1640 0.9890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 -2.1680 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -2.3040 1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 -2.3350 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 -2.2120 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -2.0860 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -2.0570 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0150 -2.3090 -0.4370 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9770 -1.4770 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9940 -0.8160 -0.5990 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.5490 -0.6310 -1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5290 0.5010 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6410 1.5030 -2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0010 1.6590 -2.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9120 2.3760 -1.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1430 1.6800 -0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8450 1.5220 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1630 -1.6410 -0.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8340 -2.5310 -1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5330 -3.8560 -0.9870 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.9500 -3.7450 -1.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6090 -4.3500 -1.9870 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3790 -4.8990 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4600 -5.0510 1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3390 -5.9080 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1560 -6.6210 2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0880 -6.4820 1.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1990 -5.6260 0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 -2.1450 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -2.9700 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 -1.1670 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -2.4000 2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 -2.4710 2.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 -2.0170 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -1.9530 -1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4730 -2.0870 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4190 -0.6870 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7850 0.3710 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8430 1.3450 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9620 0.9020 -2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1920 2.4780 -1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8870 2.2290 -3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4330 0.6850 -3.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8610 2.2650 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6010 0.7080 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4100 2.4940 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0080 0.9280 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3950 -4.5210 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1710 -6.0360 3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0710 -7.2950 3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 -7.0480 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 -5.5350 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8270 0.8010 -0.7460 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.1800 -0.1650 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 54 1 0 0 0 0 19 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END