IBS-ZINC05144317 MOE2007 3D Structure written by MMmdl. 37 39 0 0 0 0 0 0 0 0999 V2000 8.5590 -0.5660 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6260 1.1380 -1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1060 -0.5670 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 0.2830 -0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 -0.5570 -0.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 0.0510 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -0.6730 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -0.0210 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -1.0060 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 -0.9580 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -2.1550 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 -3.3850 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 -3.4570 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 -2.2510 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 -2.0200 -0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -2.7510 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 1.3270 0.0600 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 1.9510 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 1.4010 -0.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7300 -1.2660 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4180 0.0960 0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3510 -1.0970 1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8050 1.8490 -1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5570 1.6860 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7080 0.4880 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 -1.2420 0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1960 -1.1680 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 0.8960 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8480 0.9550 0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -1.5640 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9580 -0.0030 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2510 -2.1240 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -4.3030 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 -4.4160 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 3.0360 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3600 0.2830 -0.0570 N 0 3 0 0 0 0 0 0 0 0 0 0 7.2310 0.9210 0.7420 H 0 0 0 0 0 0 0 0 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 1 36 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 19 2 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 36 1 M END