CF4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4 | C4 | doub | 1.22Å | 1.22Å | |
| C4 | N3 | sing | 1.31Å | 1.31Å | |
| C4 | C4A | sing | 1.42Å | 1.42Å | |
| N3 | C2 | sing | 1.32Å | 1.32Å | |
| C2 | O2 | doub | 1.21Å | 1.21Å | |
| C2 | N1 | sing | 1.31Å | 1.31Å | |
| N1 | C10 | doub | 1.33Å | 1.33Å | |
| C4A | C10 | sing | 1.38Å | 1.38Å | |
| C4A | N5 | doub | 1.31Å | 1.31Å | |
| C10 | N10 | sing | 1.41Å | 1.41Å | |
| N5 | C5A | sing | 1.31Å | 1.31Å | |
| C5A | C6 | sing | 1.37Å | 1.37Å | Aromatic |
| C5A | C9A | doub | 1.38Å | 1.38Å | Aromatic |
| C6 | C7 | doub | 1.38Å | 1.38Å | Aromatic |
| C7 | C7M | sing | 1.49Å | 1.49Å | |
| C7 | C8 | sing | 1.35Å | 1.35Å | Aromatic |
| C8 | C8M | sing | 1.48Å | 1.48Å | |
| C8 | C9 | doub | 1.37Å | 1.37Å | Aromatic |
| C9 | C9A | sing | 1.38Å | 1.38Å | Aromatic |
| C9A | N10 | sing | 1.41Å | 1.41Å | |
| N10 | C1' | sing | 1.47Å | 1.47Å | |
| C1' | C2' | sing | 1.53Å | 1.53Å | |
| C2' | C3' | sing | 1.54Å | 1.54Å | |
| C3' | C4' | sing | 1.54Å | 1.54Å | |
| C4' | N1' | sing | 1.45Å | 1.45Å | |
| N1' | C5' | sing | 1.31Å | 1.31Å | |
| C5' | O1' | sing | 1.45Å | 1.45Å | |
| C5' | O2' | doub | 1.19Å | 1.19Å | |
| N3 | H3 | sing | 1.00Å | 1.00Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7M | H7M1 | sing | 1.10Å | 1.10Å | |
| C7M | H7M2 | sing | 1.10Å | 1.10Å | |
| C7M | H7M3 | sing | 1.10Å | 1.10Å | |
| C8M | H8M1 | sing | 1.10Å | 1.10Å | |
| C8M | H8M2 | sing | 1.10Å | 1.10Å | |
| C8M | H8M3 | sing | 1.10Å | 1.10Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C1' | H1'1 | sing | 1.10Å | 1.10Å | |
| C1' | H1'2 | sing | 1.10Å | 1.10Å | |
| C2' | H2'1 | sing | 1.10Å | 1.10Å | |
| C2' | H2'2 | sing | 1.10Å | 1.10Å | |
| C3' | H3'1 | sing | 1.10Å | 1.10Å | |
| C3' | H3'2 | sing | 1.10Å | 1.10Å | |
| C4' | H4'1 | sing | 1.10Å | 1.10Å | |
| C4' | H4'2 | sing | 1.10Å | 1.10Å | |
| N1' | H1' | sing | 1.00Å | 1.00Å | |
| O1' | HA | sing | 0.95Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O4 | C4 | N3 | 120.4° | 120.4° |
| O4 | C4 | C4A | 121.4° | 121.4° |
| N3 | C4 | C4A | 118.3° | 118.3° |
| C4 | N3 | C2 | 120.2° | 120.2° |
| C4 | N3 | H3 | 119.9° | 119.9° |
| C4 | C4A | C10 | 119.8° | 119.8° |
| C4 | C4A | N5 | 119.9° | 119.9° |
| N3 | C2 | O2 | 120.8° | 120.8° |
| N3 | C2 | N1 | 122.6° | 122.6° |
| C2 | N3 | H3 | 119.9° | 119.9° |
| O2 | C2 | N1 | 116.6° | 116.6° |
| C2 | N1 | C10 | 122.0° | 122.0° |
| N1 | C10 | C4A | 117.1° | 117.1° |
| N1 | C10 | N10 | 122.2° | 122.2° |
| C10 | C4A | N5 | 120.3° | 120.3° |
| C4A | C10 | N10 | 120.7° | 120.7° |
| C4A | N5 | C5A | 122.2° | 122.2° |
| C10 | N10 | C9A | 115.9° | 115.9° |
| C10 | N10 | C1' | 121.5° | 121.5° |
| N5 | C5A | C6 | 118.3° | 118.3° |
| N5 | C5A | C9A | 121.2° | 121.2° |
| C6 | C5A | C9A | 120.5° | 120.5° |
| C5A | C6 | C7 | 121.3° | 121.3° |
| C5A | C6 | H6 | 119.3° | 119.3° |
| C5A | C9A | C9 | 117.5° | 117.5° |
| C5A | C9A | N10 | 119.8° | 119.8° |
| C6 | C7 | C7M | 121.8° | 121.8° |
| C6 | C7 | C8 | 118.4° | 118.4° |
| C7 | C6 | H6 | 119.3° | 119.3° |
| C7M | C7 | C8 | 119.8° | 119.8° |
| C7 | C7M | H7M1 | 109.5° | 109.5° |
| C7 | C7M | H7M2 | 109.4° | 109.4° |
| C7 | C7M | H7M3 | 109.5° | 109.5° |
| C7 | C8 | C8M | 118.2° | 118.2° |
| C7 | C8 | C9 | 121.1° | 121.1° |
| C8M | C8 | C9 | 120.7° | 120.7° |
| C8 | C8M | H8M1 | 109.5° | 109.5° |
| C8 | C8M | H8M2 | 109.5° | 109.5° |
| C8 | C8M | H8M3 | 109.4° | 109.5° |
| C8 | C9 | C9A | 121.2° | 121.2° |
| C8 | C9 | H9 | 119.4° | 119.4° |
| C9 | C9A | N10 | 122.7° | 122.7° |
| C9A | C9 | H9 | 119.4° | 119.4° |
| C9A | N10 | C1' | 122.4° | 122.4° |
| N10 | C1' | C2' | 120.9° | 120.9° |
| N10 | C1' | H1'1 | 105.8° | 105.8° |
| N10 | C1' | H1'2 | 103.2° | 103.2° |
| C1' | C2' | C3' | 113.5° | 113.5° |
| C2' | C1' | H1'1 | 105.8° | 105.8° |
| C2' | C1' | H1'2 | 103.1° | 103.2° |
| C1' | C2' | H2'1 | 108.2° | 108.2° |
| C1' | C2' | H2'2 | 107.2° | 107.2° |
| C2' | C3' | C4' | 116.7° | 116.7° |
| C3' | C2' | H2'1 | 108.2° | 108.2° |
| C3' | C2' | H2'2 | 107.2° | 107.2° |
| C2' | C3' | H3'1 | 107.1° | 107.1° |
| C2' | C3' | H3'2 | 105.4° | 105.4° |
| C3' | C4' | N1' | 104.2° | 104.2° |
| C4' | C3' | H3'1 | 107.1° | 107.1° |
| C4' | C3' | H3'2 | 105.4° | 105.4° |
| C3' | C4' | H4'1 | 111.3° | 111.3° |
| C3' | C4' | H4'2 | 112.4° | 112.4° |
| C4' | N1' | C5' | 127.6° | 127.6° |
| N1' | C4' | H4'1 | 111.3° | 111.3° |
| N1' | C4' | H4'2 | 112.4° | 112.4° |
| C4' | N1' | H1' | 116.2° | 116.2° |
| N1' | C5' | O1' | 123.3° | 123.3° |
| N1' | C5' | O2' | 122.5° | 122.5° |
| C5' | N1' | H1' | 116.2° | 116.2° |
| O1' | C5' | O2' | 114.2° | 114.2° |
| C5' | O1' | HA | 109.5° | 109.5° |
| H7M1 | C7M | H7M2 | 109.4° | 109.4° |
| H7M1 | C7M | H7M3 | 109.4° | 109.4° |
| H7M2 | C7M | H7M3 | 109.5° | 109.5° |
| H8M1 | C8M | H8M2 | 109.5° | 109.5° |
| H8M1 | C8M | H8M3 | 109.5° | 109.5° |
| H8M2 | C8M | H8M3 | 109.5° | 109.5° |
| H1'1 | C1' | H1'2 | 119.0° | 119.0° |
| H2'1 | C2' | H2'2 | 112.7° | 112.7° |
| H3'1 | C3' | H3'2 | 115.4° | 115.4° |
| H4'1 | C4' | H4'2 | 105.5° | 105.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4 | C4 | N3 | C4A | 180.0° | 180.0° |
| O4 | C4 | N3 | C2 | 179.5° | 179.5° |
| O4 | C4 | C4A | C10 | 179.1° | 179.1° |
| O4 | C4 | C4A | N5 | 0.8° | 0.8° |
| O4 | C4 | N3 | H3 | 0.6° | 0.6° |
| C4 | N3 | C2 | H3 | 180.0° | 180.0° |
| C4 | N3 | C2 | O2 | 179.9° | 179.9° |
| C4 | N3 | C2 | N1 | 0.5° | 0.5° |
| N3 | C4 | C4A | C10 | 0.8° | 0.8° |
| N3 | C4 | C4A | N5 | 179.2° | 179.2° |
| C4A | C4 | N3 | C2 | 0.5° | 0.5° |
| C4 | C4A | C10 | N1 | 1.0° | 1.0° |
| C4 | C4A | C10 | N5 | 180.0° | 180.0° |
| C4 | C4A | C10 | N10 | 178.7° | 178.7° |
| C4 | C4A | N5 | C5A | 179.5° | 179.5° |
| C4A | C4 | N3 | H3 | 179.5° | 179.5° |
| N3 | C2 | O2 | N1 | 179.7° | 179.7° |
| N3 | C2 | N1 | C10 | 0.7° | 0.7° |
| O2 | C2 | N1 | C10 | 179.6° | 179.6° |
| O2 | C2 | N3 | H3 | 0.1° | 0.1° |
| C2 | N1 | C10 | C4A | 1.0° | 1.0° |
| C2 | N1 | C10 | N10 | 178.8° | 178.8° |
| N1 | C2 | N3 | H3 | 179.5° | 179.5° |
| N1 | C10 | C4A | N10 | 179.8° | 179.8° |
| N1 | C10 | C4A | N5 | 179.0° | 179.0° |
| N1 | C10 | N10 | C9A | 178.0° | 178.0° |
| N1 | C10 | N10 | C1' | 2.9° | 2.9° |
| C10 | C4A | N5 | C5A | 0.5° | 0.5° |
| C4A | C10 | N10 | C9A | 2.2° | 2.2° |
| C4A | C10 | N10 | C1' | 177.3° | 177.3° |
| N5 | C4A | C10 | N10 | 1.2° | 1.2° |
| C4A | N5 | C5A | C6 | 180.0° | 180.0° |
| C4A | N5 | C5A | C9A | 0.9° | 0.9° |
| C10 | N10 | C9A | C5A | 2.5° | 2.5° |
| C10 | N10 | C9A | C9 | 179.1° | 179.1° |
| C10 | N10 | C9A | C1' | 175.1° | 175.1° |
| C10 | N10 | C1' | C2' | 91.5° | 91.5° |
| C10 | N10 | C1' | H1'1 | 28.4° | 28.4° |
| C10 | N10 | C1' | H1'2 | 154.1° | 154.1° |
| N5 | C5A | C6 | C9A | 179.2° | 179.2° |
| N5 | C5A | C6 | C7 | 179.6° | 179.6° |
| N5 | C5A | C9A | C9 | 179.6° | 179.6° |
| N5 | C5A | C9A | N10 | 1.9° | 1.9° |
| N5 | C5A | C6 | H6 | 0.4° | 0.4° |
| C5A | C6 | C7 | H6 | 180.0° | 180.0° |
| C5A | C6 | C7 | C7M | 179.5° | 179.5° |
| C5A | C6 | C7 | C8 | 1.2° | 1.2° |
| C6 | C5A | C9A | C9 | 0.4° | 0.4° |
| C6 | C5A | C9A | N10 | 178.9° | 178.9° |
| C9A | C5A | C6 | C7 | 1.2° | 1.2° |
| C5A | C9A | C9 | C8 | 0.4° | 0.4° |
| C5A | C9A | C9 | N10 | 178.5° | 178.5° |
| C5A | C9A | N10 | C1' | 177.6° | 177.6° |
| C9A | C5A | C6 | H6 | 178.7° | 178.7° |
| C5A | C9A | C9 | H9 | 179.6° | 179.5° |
| C6 | C7 | C7M | C8 | 179.3° | 179.3° |
| C6 | C7 | C8 | C8M | 178.8° | 178.8° |
| C6 | C7 | C8 | C9 | 0.3° | 0.3° |
| C6 | C7 | C7M | H7M1 | 25.1° | 25.1° |
| C6 | C7 | C7M | H7M2 | 145.0° | 145.0° |
| C6 | C7 | C7M | H7M3 | 94.9° | 94.9° |
| C7M | C7 | C8 | C8M | 0.5° | 0.5° |
| C7M | C7 | C8 | C9 | 179.6° | 179.6° |
| C7M | C7 | C6 | H6 | 0.5° | 0.5° |
| C7 | C7M | H7M1 | H7M2 | 120.0° | 120.0° |
| C7 | C7M | H7M1 | H7M3 | 120.0° | 120.0° |
| C7 | C7M | H7M2 | H7M3 | 120.0° | 120.0° |
| C7 | C8 | C8M | C9 | 179.1° | 179.1° |
| C7 | C8 | C9 | C9A | 0.5° | 0.5° |
| C8 | C7 | C6 | H6 | 178.8° | 178.8° |
| C8 | C7 | C7M | H7M1 | 155.7° | 155.7° |
| C8 | C7 | C7M | H7M2 | 35.7° | 35.7° |
| C8 | C7 | C7M | H7M3 | 84.3° | 84.3° |
| C7 | C8 | C8M | H8M1 | 89.2° | 89.2° |
| C7 | C8 | C8M | H8M2 | 150.8° | 150.8° |
| C7 | C8 | C8M | H8M3 | 30.8° | 30.8° |
| C7 | C8 | C9 | H9 | 179.6° | 179.5° |
| C8M | C8 | C9 | C9A | 179.6° | 179.6° |
| C8 | C8M | H8M1 | H8M2 | 120.0° | 120.0° |
| C8 | C8M | H8M1 | H8M3 | 120.0° | 120.0° |
| C8 | C8M | H8M2 | H8M3 | 120.0° | 120.0° |
| C8M | C8 | C9 | H9 | 0.5° | 0.4° |
| C8 | C9 | C9A | H9 | 180.0° | 180.0° |
| C8 | C9 | C9A | N10 | 178.0° | 178.0° |
| C9 | C8 | C8M | H8M1 | 91.7° | 91.7° |
| C9 | C8 | C8M | H8M2 | 28.3° | 28.3° |
| C9 | C8 | C8M | H8M3 | 148.3° | 148.3° |
| C9 | C9A | N10 | C1' | 4.0° | 4.0° |
| C9A | N10 | C1' | C2' | 93.7° | 93.7° |
| N10 | C9A | C9 | H9 | 1.9° | 2.0° |
| C9A | N10 | C1' | H1'1 | 146.4° | 146.4° |
| C9A | N10 | C1' | H1'2 | 20.6° | 20.7° |
| N10 | C1' | C2' | H1'1 | 120.0° | 120.0° |
| N10 | C1' | C2' | H1'2 | 114.3° | 114.4° |
| N10 | C1' | C2' | C3' | 158.2° | 158.2° |
| N10 | C1' | H1'1 | H1'2 | 115.3° | 115.3° |
| N10 | C1' | C2' | H2'1 | 38.2° | 38.2° |
| N10 | C1' | C2' | H2'2 | 83.6° | 83.6° |
| C1' | C2' | C3' | H2'1 | 120.0° | 120.0° |
| C1' | C2' | C3' | H2'2 | 118.2° | 118.2° |
| C1' | C2' | C3' | C4' | 136.4° | 136.4° |
| C2' | C1' | H1'1 | H1'2 | 115.3° | 115.3° |
| C1' | C2' | H2'1 | H2'2 | 118.3° | 118.3° |
| C1' | C2' | C3' | H3'1 | 103.7° | 103.7° |
| C1' | C2' | C3' | H3'2 | 19.7° | 19.7° |
| C2' | C3' | C4' | H3'1 | 120.0° | 120.0° |
| C2' | C3' | C4' | H3'2 | 116.6° | 116.6° |
| C2' | C3' | C4' | N1' | 148.8° | 148.8° |
| C3' | C2' | C1' | H1'1 | 81.8° | 81.8° |
| C3' | C2' | C1' | H1'2 | 43.9° | 43.8° |
| C3' | C2' | H2'1 | H2'2 | 118.4° | 118.4° |
| C2' | C3' | H3'1 | H3'2 | 117.0° | 117.0° |
| C2' | C3' | C4' | H4'1 | 91.2° | 91.2° |
| C2' | C3' | C4' | H4'2 | 26.8° | 26.8° |
| C3' | C4' | N1' | H4'1 | 120.0° | 120.0° |
| C3' | C4' | N1' | H4'2 | 122.0° | 121.9° |
| C3' | C4' | N1' | C5' | 102.2° | 102.2° |
| C4' | C3' | C2' | H2'1 | 16.3° | 16.3° |
| C4' | C3' | C2' | H2'2 | 105.4° | 105.4° |
| C4' | C3' | H3'1 | H3'2 | 117.0° | 117.0° |
| C3' | C4' | H4'1 | H4'2 | 122.2° | 122.1° |
| C3' | C4' | N1' | H1' | 77.8° | 77.8° |
| C4' | N1' | C5' | H1' | 180.0° | 180.0° |
| C4' | N1' | C5' | O1' | 178.1° | 178.1° |
| C4' | N1' | C5' | O2' | 3.1° | 3.1° |
| N1' | C4' | C3' | H3'1 | 28.8° | 28.8° |
| N1' | C4' | C3' | H3'2 | 94.6° | 94.6° |
| N1' | C4' | H4'1 | H4'2 | 122.2° | 122.2° |
| N1' | C5' | O1' | O2' | 178.8° | 178.8° |
| C5' | N1' | C4' | H4'1 | 17.8° | 17.8° |
| C5' | N1' | C4' | H4'2 | 135.9° | 135.9° |
| N1' | C5' | O1' | HA | 178.9° | 178.9° |
| O1' | C5' | N1' | H1' | 1.9° | 1.9° |
| O2' | C5' | N1' | H1' | 176.9° | 176.9° |
| O2' | C5' | O1' | HA | 0.0° | 0.0° |
| H7M1 | C7M | H7M2 | H7M3 | 120.0° | 120.0° |
| H8M1 | C8M | H8M2 | H8M3 | 120.0° | 120.0° |
| H1'1 | C1' | C2' | H2'1 | 158.2° | 158.2° |
| H1'1 | C1' | C2' | H2'2 | 36.4° | 36.4° |
| H1'2 | C1' | C2' | H2'1 | 76.2° | 76.2° |
| H1'2 | C1' | C2' | H2'2 | 162.1° | 162.1° |
| H2'1 | C2' | C3' | H3'1 | 136.3° | 136.3° |
| H2'1 | C2' | C3' | H3'2 | 100.3° | 100.3° |
| H2'2 | C2' | C3' | H3'1 | 14.6° | 14.6° |
| H2'2 | C2' | C3' | H3'2 | 138.0° | 138.0° |
| H3'1 | C3' | C4' | H4'1 | 148.8° | 148.8° |
| H3'1 | C3' | C4' | H4'2 | 93.2° | 93.1° |
| H3'2 | C3' | C4' | H4'1 | 25.4° | 25.4° |
| H3'2 | C3' | C4' | H4'2 | 143.4° | 143.5° |
| H4'1 | C4' | N1' | H1' | 162.2° | 162.2° |
| H4'2 | C4' | N1' | H1' | 44.1° | 44.1° |
