7IW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O32 | C34 | sing | 1.43Å | 1.45Å | |
| N28 | C02 | doub | 1.30Å | 1.25Å | |
| C34 | C33 | sing | 1.53Å | 1.54Å | |
| N03 | C02 | sing | 1.37Å | 1.47Å | |
| N03 | C04 | sing | 1.47Å | 1.48Å | |
| C02 | N01 | sing | 1.38Å | 1.27Å | |
| C33 | O31 | sing | 1.43Å | 1.36Å | |
| C33 | C32 | sing | 1.53Å | 1.58Å | |
| C32 | C31 | sing | 1.53Å | 1.54Å | |
| C04 | C05 | sing | 1.53Å | 1.55Å | |
| C26 | C27 | doub | 1.38Å | 1.40Å | Aromatic |
| C26 | C24 | sing | 1.38Å | 1.37Å | Aromatic |
| C27 | C20 | sing | 1.39Å | 1.38Å | Aromatic |
| C05 | C06 | sing | 1.54Å | 1.48Å | |
| C05 | C13 | sing | 1.54Å | 1.54Å | |
| O16 | C15 | doub | 1.21Å | 1.19Å | |
| C31 | C06 | sing | 1.53Å | 1.52Å | |
| N19 | C20 | sing | 1.40Å | 1.52Å | |
| N19 | C17 | sing | 1.35Å | 1.48Å | |
| C20 | C21 | doub | 1.39Å | 1.39Å | Aromatic |
| C24 | CL25 | sing | 1.74Å | 1.77Å | |
| C24 | C22 | doub | 1.39Å | 1.37Å | Aromatic |
| C06 | C07 | sing | 1.51Å | 1.59Å | |
| C15 | C17 | sing | 1.49Å | 1.53Å | |
| C15 | N14 | sing | 1.35Å | 1.50Å | |
| C17 | O18 | doub | 1.21Å | 1.25Å | |
| C13 | N14 | sing | 1.46Å | 1.46Å | |
| C13 | C12 | sing | 1.51Å | 1.51Å | |
| C22 | C21 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | F23 | sing | 1.35Å | 1.33Å | |
| C07 | C12 | doub | 1.38Å | 1.41Å | Aromatic |
| C07 | C08 | sing | 1.38Å | 1.45Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.42Å | Aromatic |
| C08 | C09 | doub | 1.38Å | 1.40Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.40Å | Aromatic |
| C09 | C10 | sing | 1.38Å | 1.45Å | Aromatic |
| C09 | C00 | sing | 1.51Å | 1.60Å | |
| C00 | N | sing | 1.47Å | 1.46Å | |
| N | C | sing | 1.47Å | 1.47Å | |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C13 | H2 | sing | 1.09Å | 1.10Å | |
| C21 | H3 | sing | 1.08Å | 1.08Å | |
| C26 | H4 | sing | 1.08Å | 1.08Å | |
| N | H5 | sing | 1.01Å | 1.00Å | |
| C | H7 | sing | 1.09Å | 1.10Å | |
| C | H8 | sing | 1.09Å | 1.10Å | |
| C | H9 | sing | 1.09Å | 1.10Å | |
| C00 | H10 | sing | 1.09Å | 1.10Å | |
| C00 | H11 | sing | 1.09Å | 1.10Å | |
| C04 | H12 | sing | 1.09Å | 1.10Å | |
| C04 | H13 | sing | 1.09Å | 1.10Å | |
| C05 | H14 | sing | 1.09Å | 1.10Å | |
| C06 | H15 | sing | 1.09Å | 1.10Å | |
| C08 | H16 | sing | 1.08Å | 1.08Å | |
| C11 | H17 | sing | 1.08Å | 1.08Å | |
| C27 | H18 | sing | 1.08Å | 1.08Å | |
| C31 | H19 | sing | 1.09Å | 1.10Å | |
| C31 | H20 | sing | 1.09Å | 1.10Å | |
| C32 | H21 | sing | 1.09Å | 1.10Å | |
| C32 | H22 | sing | 1.09Å | 1.10Å | |
| C33 | H23 | sing | 1.09Å | 1.10Å | |
| C34 | H24 | sing | 1.09Å | 1.10Å | |
| C34 | H25 | sing | 1.09Å | 1.10Å | |
| N01 | H26 | sing | 0.97Å | 1.00Å | |
| N01 | H27 | sing | 0.97Å | 1.00Å | |
| N03 | H28 | sing | 0.97Å | 1.00Å | |
| N14 | H29 | sing | 0.97Å | 1.00Å | |
| N19 | H30 | sing | 0.97Å | 1.00Å | |
| N28 | H31 | sing | 0.97Å | 1.00Å | |
| O31 | H32 | sing | 0.97Å | 0.95Å | |
| O32 | H33 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O32 | C34 | C33 | 109.8° | 109.5° |
| O32 | C34 | H24 | 109.4° | 109.5° |
| O32 | C34 | H25 | 109.4° | 109.5° |
| C34 | O32 | H33 | 109.5° | 114.0° |
| N28 | C02 | N03 | 119.3° | 120.0° |
| N28 | C02 | N01 | 121.7° | 120.0° |
| C02 | N28 | H31 | 112.0° | 120.0° |
| C34 | C33 | O31 | 107.8° | 109.5° |
| C34 | C33 | C32 | 112.6° | 109.5° |
| C34 | C33 | H23 | 108.2° | 109.5° |
| C33 | C34 | H24 | 109.4° | 109.5° |
| C33 | C34 | H25 | 109.4° | 109.5° |
| C02 | N03 | C04 | 119.0° | 120.0° |
| N03 | C02 | N01 | 119.0° | 120.0° |
| C02 | N03 | H28 | 120.5° | 120.0° |
| N03 | C04 | C05 | 113.0° | 109.5° |
| N03 | C04 | H12 | 108.6° | 109.5° |
| N03 | C04 | H13 | 108.6° | 109.5° |
| C04 | N03 | H28 | 120.5° | 120.0° |
| C02 | N01 | H26 | 120.0° | 120.0° |
| C02 | N01 | H27 | 120.0° | 120.0° |
| O31 | C33 | C32 | 109.6° | 109.5° |
| O31 | C33 | H23 | 110.8° | 109.4° |
| C33 | O31 | H32 | 109.5° | 114.0° |
| C33 | C32 | C31 | 114.7° | 109.5° |
| C33 | C32 | H21 | 108.2° | 109.4° |
| C33 | C32 | H22 | 108.2° | 109.5° |
| C32 | C33 | H23 | 107.8° | 109.5° |
| C32 | C31 | C06 | 113.5° | 109.5° |
| C32 | C31 | H19 | 108.4° | 109.5° |
| C32 | C31 | H20 | 108.4° | 109.5° |
| C31 | C32 | H21 | 108.1° | 109.5° |
| C31 | C32 | H22 | 108.1° | 109.5° |
| C04 | C05 | C06 | 103.4° | 110.8° |
| C04 | C05 | C13 | 112.1° | 110.8° |
| C05 | C04 | H12 | 108.6° | 109.5° |
| C05 | C04 | H13 | 108.5° | 109.5° |
| C04 | C05 | H14 | 111.0° | 110.7° |
| C27 | C26 | C24 | 117.4° | 120.1° |
| C26 | C27 | C20 | 121.1° | 120.0° |
| C27 | C26 | H4 | 121.3° | 120.0° |
| C26 | C27 | H18 | 119.5° | 120.1° |
| C26 | C24 | CL25 | 120.1° | 120.0° |
| C26 | C24 | C22 | 121.2° | 120.1° |
| C24 | C26 | H4 | 121.3° | 119.9° |
| C27 | C20 | N19 | 117.3° | 120.1° |
| C27 | C20 | C21 | 121.3° | 119.9° |
| C20 | C27 | H18 | 119.4° | 119.9° |
| C06 | C05 | C13 | 107.1° | 102.4° |
| C05 | C06 | C31 | 116.7° | 110.3° |
| C05 | C06 | C07 | 106.3° | 105.2° |
| C06 | C05 | H14 | 112.0° | 110.8° |
| C05 | C06 | H15 | 104.4° | 110.3° |
| C05 | C13 | N14 | 106.4° | 110.3° |
| C05 | C13 | C12 | 106.4° | 105.2° |
| C05 | C13 | H2 | 112.0° | 110.3° |
| C13 | C05 | H14 | 111.0° | 111.0° |
| O16 | C15 | C17 | 120.6° | 120.1° |
| O16 | C15 | N14 | 118.5° | 120.0° |
| C31 | C06 | C07 | 120.1° | 110.3° |
| C31 | C06 | H15 | 104.0° | 110.4° |
| C06 | C31 | H19 | 108.5° | 109.4° |
| C06 | C31 | H20 | 108.4° | 109.5° |
| C20 | N19 | C17 | 123.5° | 120.0° |
| N19 | C20 | C21 | 121.3° | 120.0° |
| C20 | N19 | H30 | 118.2° | 120.0° |
| N19 | C17 | C15 | 116.2° | 119.9° |
| N19 | C17 | O18 | 122.5° | 120.0° |
| C17 | N19 | H30 | 118.3° | 120.0° |
| C20 | C21 | C22 | 116.4° | 119.9° |
| C20 | C21 | H3 | 121.8° | 120.1° |
| CL25 | C24 | C22 | 118.7° | 120.0° |
| C24 | C22 | C21 | 122.6° | 120.0° |
| C24 | C22 | F23 | 119.7° | 120.0° |
| C06 | C07 | C12 | 108.0° | 109.8° |
| C06 | C07 | C08 | 133.3° | 130.4° |
| C07 | C06 | H15 | 103.3° | 110.3° |
| C17 | C15 | N14 | 120.9° | 120.0° |
| C15 | C17 | O18 | 121.3° | 120.1° |
| C15 | N14 | C13 | 119.4° | 120.0° |
| C15 | N14 | H29 | 120.3° | 120.0° |
| N14 | C13 | C12 | 105.8° | 110.3° |
| N14 | C13 | H2 | 113.3° | 110.3° |
| C13 | N14 | H29 | 120.3° | 120.1° |
| C13 | C12 | C07 | 110.4° | 109.8° |
| C13 | C12 | C11 | 128.0° | 130.4° |
| C12 | C13 | H2 | 112.4° | 110.3° |
| C21 | C22 | F23 | 117.8° | 120.0° |
| C22 | C21 | H3 | 121.8° | 120.0° |
| C12 | C07 | C08 | 118.7° | 119.9° |
| C07 | C12 | C11 | 121.5° | 119.8° |
| C07 | C08 | C09 | 120.0° | 120.2° |
| C07 | C08 | H16 | 120.0° | 119.9° |
| C12 | C11 | C10 | 120.0° | 120.3° |
| C12 | C11 | H17 | 120.0° | 119.9° |
| C08 | C09 | C10 | 120.7° | 120.0° |
| C08 | C09 | C00 | 120.9° | 120.0° |
| C09 | C08 | H16 | 120.0° | 119.9° |
| C11 | C10 | C09 | 119.2° | 119.9° |
| C11 | C10 | H1 | 120.4° | 120.1° |
| C10 | C11 | H17 | 120.0° | 119.9° |
| C10 | C09 | C00 | 118.4° | 120.0° |
| C09 | C10 | H1 | 120.4° | 120.0° |
| C09 | C00 | N | 109.6° | 109.5° |
| C09 | C00 | H10 | 109.4° | 109.5° |
| C09 | C00 | H11 | 109.5° | 109.5° |
| C00 | N | C | 112.2° | 111.0° |
| C00 | N | H5 | 108.7° | 111.0° |
| N | C00 | H10 | 109.5° | 109.5° |
| N | C00 | H11 | 109.4° | 109.4° |
| C | N | H5 | 108.8° | 111.0° |
| N | C | H7 | 109.5° | 109.5° |
| N | C | H8 | 109.5° | 109.5° |
| N | C | H9 | 109.5° | 109.4° |
| H7 | C | H8 | 109.5° | 109.5° |
| H7 | C | H9 | 109.5° | 109.4° |
| H8 | C | H9 | 109.5° | 109.5° |
| H10 | C00 | H11 | 109.5° | 109.4° |
| H12 | C04 | H13 | 109.5° | 109.5° |
| H19 | C31 | H20 | 109.5° | 109.5° |
| H21 | C32 | H22 | 109.5° | 109.5° |
| H24 | C34 | H25 | 109.5° | 109.4° |
| H26 | N01 | H27 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O32 | C34 | C33 | H24 | 120.0° | 120.0° |
| O32 | C34 | C33 | H25 | 120.0° | 120.0° |
| O32 | C34 | C33 | O31 | 20.6° | 65.0° |
| O32 | C34 | C33 | C32 | 100.5° | 175.0° |
| O32 | C34 | C33 | H23 | 140.5° | 55.0° |
| O32 | C34 | H24 | H25 | 119.9° | 120.0° |
| N28 | C02 | N03 | N01 | 179.7° | 180.0° |
| N28 | C02 | N03 | C04 | 179.1° | 0.0° |
| N28 | C02 | N01 | H26 | 179.7° | 180.0° |
| N28 | C02 | N01 | H27 | 0.3° | 0.0° |
| N28 | C02 | N03 | H28 | 0.9° | 180.0° |
| C34 | C33 | O31 | C32 | 122.9° | 120.0° |
| C34 | C33 | O31 | H23 | 118.3° | 120.0° |
| C34 | C33 | C32 | H23 | 119.3° | 120.0° |
| C34 | C33 | C32 | C31 | 179.2° | 175.0° |
| C34 | C33 | C32 | H21 | 58.4° | 65.0° |
| C34 | C33 | C32 | H22 | 60.0° | 55.0° |
| C33 | C34 | H24 | H25 | 119.9° | 120.0° |
| C34 | C33 | O31 | H32 | 180.0° | 60.0° |
| C33 | C34 | O32 | H33 | 180.0° | 179.9° |
| C02 | N03 | C04 | H28 | 180.0° | 180.0° |
| C02 | N03 | C04 | C05 | 106.7° | 180.0° |
| C02 | N03 | C04 | H12 | 132.8° | 60.0° |
| C02 | N03 | C04 | H13 | 13.9° | 60.0° |
| N03 | C02 | N01 | H26 | 0.0° | 0.0° |
| N03 | C02 | N01 | H27 | 180.0° | 180.0° |
| N03 | C02 | N28 | H31 | 179.7° | 180.0° |
| C04 | N03 | C02 | N01 | 0.7° | 180.0° |
| N03 | C04 | C05 | H12 | 120.5° | 120.0° |
| N03 | C04 | C05 | H13 | 120.5° | 120.0° |
| N03 | C04 | C05 | C06 | 154.1° | 175.0° |
| N03 | C04 | C05 | C13 | 90.9° | 72.0° |
| N03 | C04 | H12 | H13 | 118.4° | 120.0° |
| N03 | C04 | C05 | H14 | 33.8° | 51.6° |
| C02 | N01 | H26 | H27 | 180.0° | 180.0° |
| N01 | C02 | N03 | H28 | 179.4° | 0.0° |
| N01 | C02 | N28 | H31 | 0.0° | 0.0° |
| O31 | C33 | C32 | H23 | 120.7° | 120.0° |
| O31 | C33 | C32 | C31 | 60.8° | 65.0° |
| O31 | C33 | C32 | H21 | 178.4° | 55.0° |
| O31 | C33 | C32 | H22 | 60.0° | 175.0° |
| O31 | C33 | C34 | H24 | 99.4° | 55.0° |
| O31 | C33 | C34 | H25 | 140.6° | 175.0° |
| C33 | C32 | C31 | H21 | 120.8° | 120.0° |
| C33 | C32 | C31 | H22 | 120.8° | 120.0° |
| C33 | C32 | C31 | C06 | 161.0° | 180.0° |
| C33 | C32 | C31 | H19 | 78.4° | 60.0° |
| C33 | C32 | C31 | H20 | 40.4° | 60.0° |
| C33 | C32 | H21 | H22 | 117.6° | 120.0° |
| C32 | C33 | C34 | H24 | 139.5° | 65.0° |
| C32 | C33 | C34 | H25 | 19.6° | 54.9° |
| C32 | C33 | O31 | H32 | 57.1° | 60.0° |
| C32 | C31 | C06 | C05 | 83.0° | 175.0° |
| C32 | C31 | C06 | H19 | 120.6° | 120.0° |
| C32 | C31 | C06 | H20 | 120.6° | 120.0° |
| C32 | C31 | C06 | C07 | 146.1° | 69.2° |
| C32 | C31 | C06 | H15 | 31.3° | 52.9° |
| C32 | C31 | H19 | H20 | 118.1° | 120.0° |
| C31 | C32 | H21 | H22 | 117.6° | 120.0° |
| C31 | C32 | C33 | H23 | 59.9° | 55.0° |
| C04 | C05 | C06 | C13 | 118.5° | 118.2° |
| C04 | C05 | C06 | H14 | 119.5° | 123.4° |
| C04 | C05 | C13 | H14 | 124.7° | 123.5° |
| C04 | C05 | C06 | C31 | 116.8° | 149.2° |
| C04 | C05 | C06 | C07 | 106.1° | 91.9° |
| C04 | C05 | C13 | N14 | 148.3° | 149.2° |
| C04 | C05 | C13 | C12 | 99.2° | 91.9° |
| C04 | C05 | C13 | H2 | 24.0° | 27.1° |
| C05 | C04 | H12 | H13 | 118.3° | 120.0° |
| C04 | C05 | C06 | H15 | 2.7° | 27.0° |
| C05 | C04 | N03 | H28 | 73.4° | 0.0° |
| C27 | C26 | C24 | H4 | 180.0° | 179.9° |
| C26 | C27 | C20 | H18 | 180.0° | 180.0° |
| C26 | C27 | C20 | N19 | 179.1° | 179.8° |
| C26 | C27 | C20 | C21 | 1.7° | 0.0° |
| C27 | C26 | C24 | CL25 | 179.7° | 180.0° |
| C27 | C26 | C24 | C22 | 0.1° | 0.1° |
| C24 | C26 | C27 | C20 | 1.0° | 0.1° |
| C26 | C24 | CL25 | C22 | 179.8° | 179.9° |
| C26 | C24 | C22 | C21 | 0.2° | 0.0° |
| C26 | C24 | C22 | F23 | 179.8° | 180.0° |
| C24 | C26 | C27 | H18 | 179.0° | 179.9° |
| C27 | C20 | N19 | C21 | 177.4° | 179.8° |
| C27 | C20 | N19 | C17 | 139.9° | 33.5° |
| C27 | C20 | C21 | C22 | 1.3° | 0.0° |
| C27 | C20 | C21 | H3 | 178.7° | 179.9° |
| C20 | C27 | C26 | H4 | 179.0° | 179.9° |
| C27 | C20 | N19 | H30 | 40.0° | 146.5° |
| C06 | C05 | C13 | H14 | 122.6° | 118.3° |
| C05 | C06 | C31 | C07 | 130.9° | 115.8° |
| C05 | C06 | C31 | H15 | 114.4° | 122.1° |
| C05 | C06 | C07 | H15 | 109.6° | 118.9° |
| C06 | C05 | C13 | N14 | 98.9° | 92.6° |
| C06 | C05 | C13 | C12 | 13.6° | 26.4° |
| C05 | C06 | C07 | C12 | 6.9° | 17.2° |
| C05 | C06 | C07 | C08 | 171.0° | 163.1° |
| C06 | C05 | C13 | H2 | 136.8° | 145.3° |
| C06 | C05 | C04 | H12 | 33.5° | 65.0° |
| C06 | C05 | C04 | H13 | 85.4° | 55.0° |
| C05 | C06 | C31 | H19 | 37.6° | 65.0° |
| C05 | C06 | C31 | H20 | 156.4° | 55.0° |
| C13 | C05 | C06 | C31 | 124.7° | 92.6° |
| C13 | C05 | C06 | C07 | 12.4° | 26.4° |
| C05 | C13 | N14 | C15 | 99.2° | 157.8° |
| C05 | C13 | N14 | C12 | 112.9° | 115.7° |
| C05 | C13 | N14 | H2 | 123.5° | 122.1° |
| C05 | C13 | C12 | H2 | 123.0° | 119.0° |
| C05 | C13 | C12 | C07 | 9.4° | 17.2° |
| C05 | C13 | C12 | C11 | 173.3° | 162.8° |
| C13 | C05 | C04 | H12 | 148.6° | 48.0° |
| C13 | C05 | C04 | H13 | 29.6° | 167.9° |
| C13 | C05 | C06 | H15 | 121.2° | 145.3° |
| C05 | C13 | N14 | H29 | 80.8° | 22.2° |
| O16 | C15 | C17 | N19 | 0.4° | 0.1° |
| O16 | C15 | C17 | N14 | 179.3° | 179.9° |
| O16 | C15 | C17 | O18 | 179.4° | 180.0° |
| O16 | C15 | N14 | C13 | 1.7° | 0.0° |
| O16 | C15 | N14 | H29 | 178.3° | 180.0° |
| C31 | C06 | C07 | H15 | 115.1° | 122.2° |
| C31 | C06 | C07 | C12 | 128.4° | 101.7° |
| C31 | C06 | C07 | C08 | 53.7° | 78.0° |
| C31 | C06 | C05 | H14 | 2.7° | 25.8° |
| C06 | C31 | H19 | H20 | 118.2° | 120.0° |
| C06 | C31 | C32 | H21 | 40.2° | 60.1° |
| C06 | C31 | C32 | H22 | 78.2° | 60.0° |
| C20 | N19 | C17 | H30 | 180.0° | 179.9° |
| C20 | N19 | C17 | C15 | 177.9° | 174.7° |
| C20 | N19 | C17 | O18 | 2.2° | 5.3° |
| N19 | C20 | C21 | C22 | 178.6° | 179.8° |
| N19 | C20 | C21 | H3 | 1.4° | 0.3° |
| N19 | C20 | C27 | H18 | 1.0° | 0.2° |
| C17 | N19 | C20 | C21 | 37.4° | 146.7° |
| N19 | C17 | C15 | O18 | 179.8° | 179.9° |
| N19 | C17 | C15 | N14 | 179.8° | 180.0° |
| C20 | C21 | C22 | C24 | 0.4° | 0.0° |
| C20 | C21 | C22 | H3 | 180.0° | 179.9° |
| C20 | C21 | C22 | F23 | 179.3° | 180.0° |
| C21 | C20 | C27 | H18 | 178.3° | 180.0° |
| C21 | C20 | N19 | H30 | 142.6° | 33.3° |
| CL25 | C24 | C22 | C21 | 180.0° | 180.0° |
| CL25 | C24 | C22 | F23 | 0.4° | 0.0° |
| CL25 | C24 | C26 | H4 | 0.3° | 0.1° |
| C24 | C22 | C21 | F23 | 179.7° | 180.0° |
| C24 | C22 | C21 | H3 | 179.6° | 179.9° |
| C22 | C24 | C26 | H4 | 179.9° | 179.9° |
| C06 | C07 | C12 | C13 | 1.8° | 0.0° |
| C06 | C07 | C12 | C08 | 178.2° | 179.8° |
| C06 | C07 | C12 | C11 | 179.3° | 180.0° |
| C06 | C07 | C08 | C09 | 179.1° | 179.9° |
| C07 | C06 | C05 | H14 | 134.3° | 144.8° |
| C06 | C07 | C08 | H16 | 0.9° | 0.1° |
| C07 | C06 | C31 | H19 | 93.3° | 50.7° |
| C07 | C06 | C31 | H20 | 25.5° | 170.7° |
| C17 | C15 | N14 | C13 | 179.0° | 180.0° |
| C17 | C15 | N14 | H29 | 1.0° | 0.0° |
| C15 | C17 | N19 | H30 | 2.1° | 5.2° |
| N14 | C15 | C17 | O18 | 0.1° | 0.1° |
| C15 | N14 | C13 | H29 | 180.0° | 180.0° |
| C15 | N14 | C13 | C12 | 148.0° | 86.5° |
| C15 | N14 | C13 | H2 | 24.4° | 35.7° |
| O18 | C17 | N19 | H30 | 177.8° | 174.7° |
| N14 | C13 | C12 | H2 | 124.2° | 122.1° |
| N14 | C13 | C12 | C07 | 103.5° | 101.7° |
| N14 | C13 | C12 | C11 | 73.8° | 78.3° |
| N14 | C13 | C05 | H14 | 23.7° | 25.7° |
| C13 | C12 | C07 | C11 | 177.5° | 180.0° |
| C13 | C12 | C07 | C08 | 180.0° | 179.8° |
| C13 | C12 | C11 | C10 | 179.1° | 180.0° |
| C12 | C13 | C05 | H14 | 136.1° | 144.6° |
| C13 | C12 | C11 | H17 | 0.9° | 0.0° |
| C12 | C13 | N14 | H29 | 32.1° | 93.5° |
| F23 | C22 | C21 | H3 | 0.8° | 0.1° |
| C12 | C07 | C08 | C09 | 1.5° | 0.2° |
| C07 | C12 | C11 | C10 | 2.1° | 0.0° |
| C07 | C12 | C13 | H2 | 132.4° | 136.2° |
| C12 | C07 | C06 | H15 | 116.5° | 136.1° |
| C12 | C07 | C08 | H16 | 178.5° | 179.6° |
| C07 | C12 | C11 | H17 | 177.9° | 180.0° |
| C08 | C07 | C12 | C11 | 2.5° | 0.2° |
| C07 | C08 | C09 | H16 | 180.0° | 179.8° |
| C07 | C08 | C09 | C10 | 0.1° | 0.1° |
| C07 | C08 | C09 | C00 | 179.7° | 180.0° |
| C08 | C07 | C06 | H15 | 61.4° | 44.2° |
| C12 | C11 | C10 | H17 | 180.0° | 180.0° |
| C12 | C11 | C10 | C09 | 0.6° | 0.3° |
| C12 | C11 | C10 | H1 | 179.4° | 179.9° |
| C11 | C12 | C13 | H2 | 50.3° | 43.8° |
| C08 | C09 | C10 | C11 | 0.4° | 0.3° |
| C08 | C09 | C10 | C00 | 179.8° | 180.0° |
| C08 | C09 | C00 | N | 147.6° | 90.0° |
| C08 | C09 | C10 | H1 | 179.6° | 179.9° |
| C08 | C09 | C00 | H10 | 27.5° | 30.1° |
| C08 | C09 | C00 | H11 | 92.4° | 150.0° |
| C11 | C10 | C09 | H1 | 180.0° | 179.6° |
| C11 | C10 | C09 | C00 | 179.8° | 179.7° |
| C10 | C09 | C00 | N | 32.2° | 90.0° |
| C10 | C09 | C00 | H10 | 152.2° | 150.0° |
| C10 | C09 | C00 | H11 | 87.8° | 30.0° |
| C10 | C09 | C08 | H16 | 179.9° | 179.9° |
| C09 | C10 | C11 | H17 | 179.4° | 179.7° |
| C09 | C00 | N | H10 | 120.0° | 120.0° |
| C09 | C00 | N | H11 | 120.0° | 120.0° |
| C09 | C00 | N | C | 158.4° | 180.0° |
| C00 | C09 | C10 | H1 | 0.2° | 0.1° |
| C09 | C00 | N | H5 | 38.0° | 56.1° |
| C09 | C00 | H10 | H11 | 120.0° | 120.0° |
| C00 | C09 | C08 | H16 | 0.3° | 0.1° |
| C00 | N | C | H5 | 120.4° | 123.9° |
| C00 | N | C | H7 | 180.0° | 60.1° |
| C00 | N | C | H8 | 60.0° | 60.0° |
| C00 | N | C | H9 | 60.0° | 180.0° |
| N | C00 | H10 | H11 | 119.9° | 120.0° |
| N | C | H7 | H8 | 120.0° | 120.0° |
| N | C | H7 | H9 | 120.0° | 119.9° |
| N | C | H8 | H9 | 120.0° | 120.0° |
| C | N | C00 | H10 | 81.6° | 59.9° |
| C | N | C00 | H11 | 38.4° | 60.0° |
| H1 | C10 | C11 | H17 | 0.6° | 0.1° |
| H2 | C13 | C05 | H14 | 100.7° | 96.4° |
| H2 | C13 | N14 | H29 | 155.7° | 144.4° |
| H4 | C26 | C27 | H18 | 1.0° | 0.0° |
| H5 | N | C | H7 | 59.6° | 176.0° |
| H5 | N | C | H8 | 179.6° | 64.0° |
| H5 | N | C | H9 | 60.4° | 56.1° |
| H5 | N | C00 | H10 | 158.0° | 64.0° |
| H5 | N | C00 | H11 | 82.0° | 176.1° |
| H7 | C | H8 | H9 | 120.0° | 120.0° |
| H12 | C04 | C05 | H14 | 86.7° | 171.6° |
| H12 | C04 | N03 | H28 | 47.1° | 120.0° |
| H13 | C04 | C05 | H14 | 154.3° | 68.4° |
| H13 | C04 | N03 | H28 | 166.1° | 120.0° |
| H14 | C05 | C06 | H15 | 116.9° | 96.3° |
| H15 | C06 | C31 | H19 | 151.9° | 172.9° |
| H15 | C06 | C31 | H20 | 89.3° | 67.2° |
| H19 | C31 | C32 | H21 | 160.8° | 180.0° |
| H19 | C31 | C32 | H22 | 42.4° | 60.0° |
| H20 | C31 | C32 | H21 | 80.4° | 60.0° |
| H20 | C31 | C32 | H22 | 161.2° | NaN° |
| H21 | C32 | C33 | H23 | 60.9° | 175.0° |
| H22 | C32 | C33 | H23 | 179.3° | 65.1° |
| H23 | C33 | C34 | H24 | 20.5° | 175.0° |
| H23 | C33 | C34 | H25 | 99.5° | 65.1° |
| H23 | C33 | O31 | H32 | 61.8° | 180.0° |
| H24 | C34 | O32 | H33 | 60.0° | 59.9° |
| H25 | C34 | O32 | H33 | 59.9° | 60.1° |
