C ( 1) 0.000000 0 0.000000 0 0.000000 0 0 0 0 C ( 2) 1.410693 1 0.000000 0 0.000000 0 1 0 0 C ( 3) 2.086647 1 100.648428 1 0.000000 0 2 1 0 C ( 4) 1.410693 1 79.353562 1 359.991445 1 3 2 1 H ( 5) 1.092599 1 119.330275 1 260.216798 1 2 1 3 H ( 6) 1.105815 1 102.630315 1 116.635669 1 3 2 4 H ( 7) 1.094562 1 121.653215 1 257.194089 1 4 3 2 H ( 8) 1.105812 1 118.057273 1 98.743091 1 1 2 3 N ( 9) 1.470844 1 122.254116 1 152.263135 1 1 2 8 H ( 10) 1.094563 1 121.653065 1 202.594108 1 2 1 5 N ( 11) 1.470847 1 111.666717 1 122.724439 1 3 2 6 H ( 12) 1.092597 1 119.331087 1 202.590333 1 4 3 7 O ( 17) 1.213849 1 119.081647 1 255.122635 1 11 3 2 O ( 18) 1.213851 1 119.082265 1 195.779850 1 9 1 2 O ( 19) 1.220735 1 119.077184 1 178.420644 1 11 3 13 O ( 20) 1.220735 1 119.076499 1 181.581551 1 9 1 14 0.000000 0 0.000000 0 0.000000 0