4PQ - Ideal conformer RDKit 3D 28 29 0 0 0 0 0 0 0 0999 V2000 1.4630 -1.1060 -1.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 0.0240 -0.4440 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4880 0.5400 0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 1.1050 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 2.3930 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 2.5280 -0.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 1.2970 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3780 0.8770 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7060 -0.4540 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -1.3910 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -0.9940 0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 0.3530 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 -0.4280 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5800 0.4750 0.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 -1.6030 0.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -2.7010 0.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -1.4240 -1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -1.8600 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 0.8230 -1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -0.2810 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 1.3200 1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 3.2020 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 3.3640 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1340 1.5950 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7200 -0.7750 -0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -1.7210 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 0.1370 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -2.9470 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 16 10 1 0 10 11 1 0 10 9 2 0 11 12 2 0 9 8 1 0 12 7 1 0 12 4 1 0 8 7 2 0 3 4 1 0 3 2 1 0 7 6 1 0 1 2 1 0 4 5 2 0 2 13 1 0 6 5 1 0 13 15 2 0 13 14 1 0 1 17 1 0 1 18 1 0 2 19 1 6 3 20 1 0 3 21 1 0 5 22 1 0 6 23 1 0 8 24 1 0 9 25 1 0 11 26 1 0 14 27 1 0 16 28 1 0 M END