IBS-ZINC00486025 MOE2007 3D Structure written by MMmdl. 37 39 0 0 0 0 0 0 0 0999 V2000 2.5160 -2.6760 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -2.0430 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4130 0.0220 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 1.4000 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 1.3770 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 -1.1660 -0.7000 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.0620 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 3.5640 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 4.2300 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 5.6430 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 6.2730 0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 6.3270 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 7.7180 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 8.3190 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 7.5450 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 6.1690 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 5.5440 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 4.1980 0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 9.7950 0.0520 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6320 10.4770 0.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 10.3290 0.0640 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0610 -2.3720 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 -2.3810 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 -3.7580 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 -0.5090 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3330 1.9480 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 -0.6140 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 0.6860 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 0.6950 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 3.6820 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 8.3210 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 8.0270 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 5.5770 0.0500 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END