ASINEX-ZINC04903485 MOE2007 3D Structure written by MMmdl. 41 44 0 0 0 0 0 0 0 0999 V2000 0.6630 17.1450 1.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 16.0070 0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 16.2840 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 15.2690 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 13.9730 -0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 13.6900 0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 14.6820 1.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 12.3120 0.5920 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 11.8010 1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 11.7720 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 10.3650 -0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 9.8690 -2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 8.4950 -2.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 7.6450 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 8.1030 -0.1450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 9.4380 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 5.8890 -1.6670 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 5.2720 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 3.7690 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 2.9770 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 1.5920 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 1.0340 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 1.8920 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 3.2390 0.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 17.4090 2.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 16.8740 2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 18.0250 1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 17.3210 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 15.4770 -2.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 14.4370 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 10.5300 -2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 8.1050 -3.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 9.7380 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 5.5960 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 5.6970 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 3.4230 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 0.9530 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 -0.0410 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 1.5070 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 12.7520 -1.4630 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2990 12.6290 -2.4360 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 2 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 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END