A1ICP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C1 | sing | 1.35Å | 1.40Å | |
| C1 | N2 | doub | 1.31Å | 1.30Å | |
| N2 | C2 | sing | 1.34Å | 1.36Å | |
| C2 | C3 | doub | 1.37Å | 1.39Å | |
| C3 | C4 | sing | 1.42Å | 1.38Å | |
| N1 | C4 | sing | 1.35Å | 1.40Å | |
| C3 | N3 | sing | 1.40Å | 1.40Å | |
| N3 | C5 | sing | 1.35Å | 1.34Å | |
| C5 | O1 | sing | 1.35Å | 1.33Å | |
| C4 | O2 | doub | 1.22Å | 1.22Å | |
| C5 | O3 | doub | 1.22Å | 1.21Å | |
| O1 | C6 | sing | 1.45Å | 1.48Å | |
| C6 | C7 | sing | 1.53Å | 1.52Å | |
| C6 | C8 | sing | 1.53Å | 1.51Å | |
| C6 | C9 | sing | 1.53Å | 1.51Å | |
| N1 | C10 | sing | 1.47Å | 1.46Å | |
| C10 | C11 | sing | 1.53Å | 1.53Å | |
| C10 | C12 | sing | 1.51Å | 1.51Å | |
| C11 | C13 | sing | 1.53Å | 1.50Å | |
| C12 | O4 | doub | 1.21Å | 1.23Å | |
| C12 | N4 | sing | 1.35Å | 1.34Å | |
| N4 | C14 | sing | 1.46Å | 1.46Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C14 | C16 | sing | 1.53Å | 1.54Å | |
| C16 | C17 | sing | 1.51Å | 1.51Å | |
| C17 | N5 | sing | 1.35Å | 1.49Å | |
| C13 | C18 | sing | 1.53Å | 1.49Å | |
| C18 | C19 | sing | 1.53Å | 1.51Å | |
| C13 | C19 | sing | 1.53Å | 1.49Å | |
| C15 | C20 | sing | 1.53Å | 1.54Å | |
| C20 | C21 | sing | 1.51Å | 1.52Å | |
| C21 | N6 | sing | 1.34Å | 1.33Å | |
| N6 | C22 | sing | 1.47Å | 1.46Å | |
| C22 | C23 | sing | 1.54Å | 1.54Å | |
| C20 | C23 | sing | 1.55Å | 1.53Å | |
| C21 | O5 | doub | 1.21Å | 1.24Å | |
| C16 | O6 | sing | 1.43Å | 1.39Å | |
| C17 | O7 | doub | 1.21Å | 1.18Å | |
| N3 | H3 | sing | 0.97Å | 1.00Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H9 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H16 | sing | 1.09Å | 1.10Å | |
| C15 | H20 | sing | 1.09Å | 1.10Å | |
| C15 | H19 | sing | 1.09Å | 1.10Å | |
| C20 | H29 | sing | 1.09Å | 1.10Å | |
| C22 | H32 | sing | 1.09Å | 1.10Å | |
| C22 | H31 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C9 | H11 | sing | 1.09Å | 1.10Å | |
| C9 | H10 | sing | 1.09Å | 1.10Å | |
| C9 | H12 | sing | 1.09Å | 1.10Å | |
| C11 | H14 | sing | 1.09Å | 1.10Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| N4 | H17 | sing | 0.97Å | 1.00Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| N5 | H22 | sing | 0.97Å | 1.00Å | |
| N5 | H23 | sing | 0.97Å | 1.00Å | |
| C18 | H26 | sing | 1.09Å | 1.10Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| C19 | H27 | sing | 1.09Å | 1.10Å | |
| N6 | H30 | sing | 0.97Å | 1.00Å | |
| C23 | H34 | sing | 1.09Å | 1.10Å | |
| C23 | H33 | sing | 1.09Å | 1.10Å | |
| O6 | H35 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N1 | C1 | N2 | 120.1° | 121.6° |
| C1 | N1 | C4 | 121.9° | 120.0° |
| C1 | N1 | C10 | 119.7° | 120.0° |
| N1 | C1 | H1 | 120.0° | 119.2° |
| C1 | N2 | C2 | 119.7° | 121.5° |
| N2 | C1 | H1 | 119.9° | 119.1° |
| N2 | C2 | C3 | 122.6° | 119.9° |
| N2 | C2 | H2 | 118.7° | 120.0° |
| C2 | C3 | C4 | 119.0° | 118.4° |
| C2 | C3 | N3 | 123.2° | 120.8° |
| C3 | C2 | H2 | 118.7° | 120.0° |
| C3 | C4 | N1 | 116.5° | 118.5° |
| C4 | C3 | N3 | 117.8° | 120.7° |
| C3 | C4 | O2 | 125.5° | 120.7° |
| N1 | C4 | O2 | 118.0° | 120.8° |
| C4 | N1 | C10 | 118.2° | 120.0° |
| C3 | N3 | C5 | 124.8° | 120.0° |
| C3 | N3 | H3 | 117.6° | 120.0° |
| N3 | C5 | O1 | 107.7° | 120.0° |
| N3 | C5 | O3 | 124.4° | 120.0° |
| C5 | N3 | H3 | 117.6° | 120.0° |
| O1 | C5 | O3 | 127.9° | 120.0° |
| C5 | O1 | C6 | 123.1° | 117.0° |
| O1 | C6 | C7 | 109.3° | 109.5° |
| O1 | C6 | C8 | 106.3° | 109.5° |
| O1 | C6 | C9 | 106.5° | 109.5° |
| C7 | C6 | C8 | 112.2° | 109.5° |
| C7 | C6 | C9 | 110.4° | 109.5° |
| C6 | C7 | H6 | 109.5° | 109.5° |
| C6 | C7 | H4 | 109.5° | 109.5° |
| C6 | C7 | H5 | 109.5° | 109.5° |
| C8 | C6 | C9 | 112.0° | 109.5° |
| C6 | C8 | H9 | 109.5° | 109.4° |
| C6 | C8 | H8 | 109.5° | 109.4° |
| C6 | C8 | H7 | 109.5° | 109.5° |
| C6 | C9 | H11 | 109.5° | 109.5° |
| C6 | C9 | H10 | 109.5° | 109.5° |
| C6 | C9 | H12 | 109.4° | 109.5° |
| N1 | C10 | C11 | 113.3° | 109.5° |
| N1 | C10 | C12 | 108.6° | 109.5° |
| N1 | C10 | H13 | 108.1° | 109.5° |
| C11 | C10 | C12 | 111.9° | 109.5° |
| C10 | C11 | C13 | 112.6° | 109.5° |
| C11 | C10 | H13 | 107.3° | 109.4° |
| C10 | C11 | H14 | 108.7° | 109.5° |
| C10 | C11 | H15 | 108.7° | 109.5° |
| C10 | C12 | O4 | 120.1° | 120.0° |
| C10 | C12 | N4 | 114.8° | 120.0° |
| C12 | C10 | H13 | 107.5° | 109.5° |
| C11 | C13 | C18 | 120.6° | 117.5° |
| C11 | C13 | C19 | 120.9° | 117.6° |
| C11 | C13 | H16 | 114.7° | 115.6° |
| C13 | C11 | H14 | 108.7° | 109.4° |
| C13 | C11 | H15 | 108.7° | 109.4° |
| O4 | C12 | N4 | 124.9° | 120.0° |
| C12 | N4 | C14 | 124.3° | 120.0° |
| C12 | N4 | H17 | 117.8° | 120.0° |
| N4 | C14 | C15 | 113.1° | 109.5° |
| N4 | C14 | C16 | 108.8° | 109.5° |
| C14 | N4 | H17 | 117.8° | 120.0° |
| N4 | C14 | H18 | 103.5° | 109.5° |
| C15 | C14 | C16 | 123.3° | 109.5° |
| C14 | C15 | C20 | 107.6° | 109.5° |
| C14 | C15 | H20 | 110.0° | 109.5° |
| C14 | C15 | H19 | 109.9° | 109.5° |
| C15 | C14 | H18 | 102.8° | 109.5° |
| C14 | C16 | C17 | 120.4° | 109.4° |
| C14 | C16 | O6 | 122.9° | 109.4° |
| C16 | C14 | H18 | 102.7° | 109.4° |
| C14 | C16 | H21 | 90.9° | 109.5° |
| C16 | C17 | N5 | 105.7° | 120.0° |
| C17 | C16 | O6 | 116.7° | 109.5° |
| C16 | C17 | O7 | 126.3° | 120.0° |
| C17 | C16 | H21 | 90.9° | 109.5° |
| N5 | C17 | O7 | 124.5° | 120.0° |
| C17 | N5 | H22 | 120.0° | 120.0° |
| C17 | N5 | H23 | 120.0° | 120.0° |
| C13 | C18 | C19 | 59.7° | 60.0° |
| C18 | C13 | C19 | 60.6° | 60.0° |
| C18 | C13 | H16 | 114.8° | 117.4° |
| C13 | C18 | H26 | 120.1° | 117.5° |
| C13 | C18 | H25 | 120.0° | 117.5° |
| C18 | C19 | C13 | 59.7° | 60.0° |
| C19 | C18 | H26 | 120.0° | 117.5° |
| C19 | C18 | H25 | 120.0° | 117.5° |
| C18 | C19 | H28 | 120.1° | 117.5° |
| C18 | C19 | H27 | 120.0° | 117.5° |
| C19 | C13 | H16 | 114.8° | 117.5° |
| C13 | C19 | H28 | 120.1° | 117.5° |
| C13 | C19 | H27 | 120.0° | 117.5° |
| C15 | C20 | C21 | 108.6° | 110.5° |
| C15 | C20 | C23 | 117.4° | 110.5° |
| C20 | C15 | H20 | 109.9° | 109.5° |
| C20 | C15 | H19 | 109.9° | 109.5° |
| C15 | C20 | H29 | 108.5° | 110.5° |
| C20 | C21 | N6 | 109.4° | 110.1° |
| C21 | C20 | C23 | 104.6° | 104.2° |
| C20 | C21 | O5 | 124.5° | 124.9° |
| C21 | C20 | H29 | 108.8° | 110.5° |
| C21 | N6 | C22 | 115.0° | 111.3° |
| N6 | C21 | O5 | 126.0° | 125.0° |
| C21 | N6 | H30 | 122.5° | 124.4° |
| N6 | C22 | C23 | 104.1° | 105.5° |
| N6 | C22 | H32 | 110.8° | 110.2° |
| N6 | C22 | H31 | 110.8° | 110.3° |
| C22 | N6 | H30 | 122.5° | 124.3° |
| C22 | C23 | C20 | 106.3° | 101.7° |
| C23 | C22 | H32 | 110.8° | 110.2° |
| C23 | C22 | H31 | 110.8° | 110.3° |
| C22 | C23 | H34 | 110.3° | 111.0° |
| C22 | C23 | H33 | 110.3° | 111.0° |
| C23 | C20 | H29 | 108.6° | 110.6° |
| C20 | C23 | H34 | 110.2° | 111.0° |
| C20 | C23 | H33 | 110.3° | 110.9° |
| O6 | C16 | H21 | 90.9° | 109.5° |
| C16 | O6 | H35 | 109.5° | 114.0° |
| H6 | C7 | H4 | 109.5° | 109.4° |
| H6 | C7 | H5 | 109.5° | 109.4° |
| H4 | C7 | H5 | 109.5° | 109.5° |
| H9 | C8 | H8 | 109.4° | 109.5° |
| H9 | C8 | H7 | 109.5° | 109.5° |
| H8 | C8 | H7 | 109.4° | 109.5° |
| H20 | C15 | H19 | 109.4° | 109.5° |
| H32 | C22 | H31 | 109.5° | 110.2° |
| H11 | C9 | H10 | 109.5° | 109.5° |
| H11 | C9 | H12 | 109.5° | 109.4° |
| H10 | C9 | H12 | 109.5° | 109.5° |
| H14 | C11 | H15 | 109.4° | 109.5° |
| H22 | N5 | H23 | 120.0° | 120.0° |
| H26 | C18 | H25 | 109.5° | 115.6° |
| H28 | C19 | H27 | 109.5° | 115.5° |
| H34 | C23 | H33 | 109.5° | 110.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C1 | N2 | H1 | 180.0° | 179.9° |
| N1 | C1 | N2 | C2 | 2.7° | 0.0° |
| C1 | N1 | C4 | C3 | 4.8° | 0.0° |
| C1 | N1 | C4 | C10 | 174.6° | 179.7° |
| C1 | N1 | C4 | O2 | 177.3° | 180.0° |
| C1 | N1 | C10 | C11 | 22.8° | 60.0° |
| C1 | N1 | C10 | C12 | 102.1° | 60.0° |
| C1 | N1 | C10 | H13 | 141.5° | 179.9° |
| C1 | N2 | C2 | C3 | 2.4° | 0.0° |
| N2 | C1 | N1 | C4 | 4.0° | 0.0° |
| N2 | C1 | N1 | C10 | 178.5° | 179.7° |
| C1 | N2 | C2 | H2 | 177.6° | 180.0° |
| N2 | C2 | C3 | H2 | 180.0° | 180.0° |
| N2 | C2 | C3 | C4 | 3.3° | 0.0° |
| N2 | C2 | C3 | N3 | 179.5° | 179.9° |
| C2 | N2 | C1 | H1 | 177.3° | 180.0° |
| C2 | C3 | C4 | N3 | 177.3° | 180.0° |
| C2 | C3 | C4 | N1 | 4.3° | 0.0° |
| C2 | C3 | N3 | C5 | 30.7° | 121.3° |
| C2 | C3 | C4 | O2 | 178.0° | 180.0° |
| C2 | C3 | N3 | H3 | 149.4° | 58.6° |
| C3 | C4 | N1 | O2 | 177.9° | 180.0° |
| C4 | C3 | N3 | C5 | 146.6° | 58.7° |
| C3 | C4 | N1 | C10 | 179.3° | 179.7° |
| C4 | C3 | N3 | H3 | 33.4° | 121.4° |
| C4 | C3 | C2 | H2 | 176.7° | 179.9° |
| N1 | C4 | C3 | N3 | 178.4° | 180.0° |
| C4 | N1 | C10 | C11 | 162.5° | 119.7° |
| C4 | N1 | C10 | C12 | 72.6° | 120.3° |
| C4 | N1 | C10 | H13 | 43.8° | 0.2° |
| C4 | N1 | C1 | H1 | 176.0° | 180.0° |
| C3 | N3 | C5 | H3 | 180.0° | 180.0° |
| C3 | N3 | C5 | O1 | 174.0° | 174.9° |
| N3 | C3 | C4 | O2 | 0.6° | 0.0° |
| C3 | N3 | C5 | O3 | 5.3° | 5.1° |
| N3 | C3 | C2 | H2 | 0.5° | 0.1° |
| N3 | C5 | O1 | O3 | 179.3° | 180.0° |
| N3 | C5 | O1 | C6 | 166.7° | 180.0° |
| C5 | O1 | C6 | C7 | 59.6° | 60.0° |
| C5 | O1 | C6 | C8 | 61.7° | 180.0° |
| C5 | O1 | C6 | C9 | 178.8° | 60.0° |
| O1 | C5 | N3 | H3 | 6.0° | 5.1° |
| O2 | C4 | N1 | C10 | 2.8° | 0.3° |
| O3 | C5 | O1 | C6 | 12.7° | 0.0° |
| O3 | C5 | N3 | H3 | 174.7° | 175.0° |
| O1 | C6 | C7 | C8 | 117.6° | 120.0° |
| O1 | C6 | C7 | C9 | 116.8° | 120.0° |
| O1 | C6 | C8 | C9 | 115.9° | 120.0° |
| O1 | C6 | C7 | H6 | 180.0° | 180.0° |
| O1 | C6 | C7 | H4 | 60.0° | 60.1° |
| O1 | C6 | C7 | H5 | 60.0° | 60.0° |
| O1 | C6 | C8 | H9 | 180.0° | 60.0° |
| O1 | C6 | C8 | H8 | 60.0° | 60.0° |
| O1 | C6 | C8 | H7 | 60.0° | 180.0° |
| O1 | C6 | C9 | H11 | 180.0° | 180.0° |
| O1 | C6 | C9 | H10 | 60.0° | 60.0° |
| O1 | C6 | C9 | H12 | 60.0° | 60.1° |
| C7 | C6 | C8 | C9 | 124.7° | 120.0° |
| C6 | C7 | H6 | H4 | 120.0° | 120.0° |
| C6 | C7 | H6 | H5 | 120.0° | 120.0° |
| C6 | C7 | H4 | H5 | 120.0° | 120.1° |
| C7 | C6 | C8 | H9 | 60.6° | 60.0° |
| C7 | C6 | C8 | H8 | 59.4° | 180.0° |
| C7 | C6 | C8 | H7 | 179.4° | 60.0° |
| C7 | C6 | C9 | H11 | 61.4° | 60.0° |
| C7 | C6 | C9 | H10 | 178.5° | 180.0° |
| C7 | C6 | C9 | H12 | 58.5° | 60.0° |
| C8 | C6 | C7 | H6 | 62.4° | 60.0° |
| C8 | C6 | C7 | H4 | 177.6° | 180.0° |
| C8 | C6 | C7 | H5 | 57.6° | 60.0° |
| C6 | C8 | H9 | H8 | 120.0° | 119.9° |
| C6 | C8 | H9 | H7 | 120.0° | 120.0° |
| C6 | C8 | H8 | H7 | 120.0° | 120.0° |
| C8 | C6 | C9 | H11 | 64.3° | 60.0° |
| C8 | C6 | C9 | H10 | 55.8° | 60.0° |
| C8 | C6 | C9 | H12 | 175.8° | 180.0° |
| C9 | C6 | C7 | H6 | 63.2° | 60.0° |
| C9 | C6 | C7 | H4 | 56.8° | 60.0° |
| C9 | C6 | C7 | H5 | 176.8° | 180.0° |
| C9 | C6 | C8 | H9 | 64.1° | 180.0° |
| C9 | C6 | C8 | H8 | 175.9° | 60.0° |
| C9 | C6 | C8 | H7 | 55.9° | 60.0° |
| C6 | C9 | H11 | H10 | 120.0° | 120.0° |
| C6 | C9 | H11 | H12 | 120.0° | 120.0° |
| C6 | C9 | H10 | H12 | 120.0° | 120.0° |
| N1 | C10 | C11 | C12 | 123.1° | 120.0° |
| N1 | C10 | C11 | H13 | 119.2° | 120.0° |
| N1 | C10 | C12 | H13 | 116.7° | 120.0° |
| N1 | C10 | C11 | C13 | 67.1° | 65.0° |
| N1 | C10 | C12 | O4 | 34.1° | 0.0° |
| N1 | C10 | C12 | N4 | 141.0° | 180.0° |
| C10 | N1 | C1 | H1 | 1.5° | 0.3° |
| N1 | C10 | C11 | H14 | 53.3° | 55.0° |
| N1 | C10 | C11 | H15 | 172.4° | 175.0° |
| C11 | C10 | C12 | H13 | 117.5° | 119.9° |
| C10 | C11 | C13 | H14 | 120.5° | 120.0° |
| C10 | C11 | C13 | H15 | 120.5° | 120.0° |
| C11 | C10 | C12 | O4 | 91.7° | 120.0° |
| C11 | C10 | C12 | N4 | 93.2° | 60.0° |
| C10 | C11 | C13 | C18 | 155.1° | 175.0° |
| C10 | C11 | C13 | C19 | 83.3° | 116.4° |
| C10 | C11 | C13 | H16 | 61.1° | 29.3° |
| C10 | C11 | H14 | H15 | 118.6° | 120.1° |
| C12 | C10 | C11 | C13 | 169.7° | 175.0° |
| C10 | C12 | O4 | N4 | 174.6° | 179.9° |
| C10 | C12 | N4 | C14 | 176.1° | 180.0° |
| C12 | C10 | C11 | H14 | 69.8° | 65.0° |
| C12 | C10 | C11 | H15 | 49.3° | 55.0° |
| C10 | C12 | N4 | H17 | 3.9° | 0.1° |
| C11 | C13 | C18 | C19 | 110.6° | 107.5° |
| C11 | C13 | C18 | H16 | 143.8° | 145.0° |
| C11 | C13 | C19 | H16 | 144.3° | 145.1° |
| C13 | C11 | C10 | H13 | 52.0° | 55.0° |
| C13 | C11 | H14 | H15 | 118.6° | 119.9° |
| C11 | C13 | C18 | H26 | 140.0° | 145.0° |
| C11 | C13 | C18 | H25 | 1.2° | 0.1° |
| C11 | C13 | C19 | H28 | 140.5° | 0.0° |
| C11 | C13 | C19 | H27 | 0.7° | 145.0° |
| O4 | C12 | N4 | C14 | 9.1° | 0.1° |
| O4 | C12 | C10 | H13 | 150.8° | 120.0° |
| O4 | C12 | N4 | H17 | 170.9° | 180.0° |
| C12 | N4 | C14 | H17 | 180.0° | 179.9° |
| C12 | N4 | C14 | C15 | 123.9° | 156.4° |
| C12 | N4 | C14 | C16 | 95.3° | 83.5° |
| N4 | C12 | C10 | H13 | 24.3° | 59.9° |
| C12 | N4 | C14 | H18 | 13.3° | 36.4° |
| N4 | C14 | C15 | C16 | 134.3° | 120.0° |
| N4 | C14 | C15 | H18 | 110.9° | 120.0° |
| N4 | C14 | C16 | H18 | 109.2° | 120.0° |
| N4 | C14 | C16 | C17 | 178.5° | 175.8° |
| N4 | C14 | C15 | C20 | 66.8° | 64.9° |
| N4 | C14 | C16 | O6 | 1.6° | 64.2° |
| N4 | C14 | C15 | H20 | 52.9° | 175.0° |
| N4 | C14 | C15 | H19 | 173.5° | 55.0° |
| N4 | C14 | C16 | H21 | 90.0° | 55.8° |
| C15 | C14 | C16 | H18 | 114.9° | 120.0° |
| C15 | C14 | C16 | C17 | 42.5° | 64.1° |
| C14 | C15 | C20 | H20 | 119.7° | 120.0° |
| C14 | C15 | C20 | H19 | 119.7° | 120.0° |
| C14 | C15 | C20 | C21 | 175.7° | 66.4° |
| C14 | C15 | C20 | C23 | 66.0° | 178.8° |
| C15 | C14 | C16 | O6 | 134.3° | 55.8° |
| C14 | C15 | H20 | H19 | 120.8° | 120.0° |
| C14 | C15 | C20 | H29 | 57.6° | 56.1° |
| C15 | C14 | N4 | H17 | 56.1° | 23.6° |
| C15 | C14 | C16 | H21 | 134.0° | 175.9° |
| C14 | C16 | C17 | O6 | 177.0° | 119.9° |
| C14 | C16 | C17 | H21 | 91.5° | 120.0° |
| C14 | C16 | C17 | N5 | 136.4° | 66.9° |
| C16 | C14 | C15 | C20 | 158.9° | 175.0° |
| C14 | C16 | O6 | H21 | 91.6° | 120.0° |
| C14 | C16 | C17 | O7 | 22.9° | 113.2° |
| C16 | C14 | C15 | H20 | 81.4° | 55.0° |
| C16 | C14 | C15 | H19 | 39.2° | 65.0° |
| C16 | C14 | N4 | H17 | 84.7° | 96.4° |
| C14 | C16 | O6 | H35 | 180.0° | 60.0° |
| C16 | C17 | N5 | O7 | 159.7° | 179.9° |
| C17 | C16 | O6 | H21 | 91.4° | 120.0° |
| C17 | C16 | C14 | H18 | 72.4° | 55.9° |
| C16 | C17 | N5 | H22 | 159.7° | 175.0° |
| C16 | C17 | N5 | H23 | 20.3° | 5.1° |
| C17 | C16 | O6 | H35 | 3.1° | 180.0° |
| N5 | C17 | C16 | O6 | 46.6° | 173.2° |
| N5 | C17 | C16 | H21 | 44.8° | 53.2° |
| C17 | N5 | H22 | H23 | 180.0° | 179.9° |
| C13 | C18 | C19 | H26 | 109.4° | 107.6° |
| C13 | C18 | C19 | H25 | 109.4° | 107.4° |
| C18 | C13 | C19 | H16 | 105.6° | 107.4° |
| C18 | C13 | C11 | H14 | 84.4° | 54.9° |
| C18 | C13 | C11 | H15 | 34.7° | 65.0° |
| C13 | C18 | H26 | H25 | 144.9° | 145.7° |
| C18 | C13 | C19 | H28 | 109.4° | 107.5° |
| C18 | C13 | C19 | H27 | 109.4° | 107.5° |
| C19 | C18 | H26 | H25 | 144.9° | 145.7° |
| C18 | C19 | H28 | H27 | 144.9° | 145.7° |
| C19 | C13 | C11 | H14 | 156.3° | 123.6° |
| C19 | C13 | C11 | H15 | 37.2° | 3.6° |
| C13 | C19 | H28 | H27 | 144.9° | 145.7° |
| C15 | C20 | C21 | C23 | 126.1° | 118.6° |
| C15 | C20 | C21 | H29 | 117.9° | 122.6° |
| C15 | C20 | C21 | N6 | 130.3° | 102.4° |
| C15 | C20 | C23 | C22 | 127.8° | 93.9° |
| C15 | C20 | C23 | H29 | 123.5° | 122.6° |
| C15 | C20 | C21 | O5 | 46.1° | 77.6° |
| C20 | C15 | H20 | H19 | 120.8° | 120.0° |
| C20 | C15 | C14 | H18 | 44.1° | 55.0° |
| C15 | C20 | C23 | H34 | 112.7° | 24.3° |
| C15 | C20 | C23 | H33 | 8.3° | 147.9° |
| C20 | C21 | N6 | O5 | 176.4° | 180.0° |
| C20 | C21 | N6 | C22 | 1.0° | 0.4° |
| C21 | C20 | C23 | C22 | 7.4° | 24.8° |
| C21 | C20 | C23 | H29 | 116.1° | 118.7° |
| C21 | C20 | C15 | H20 | 55.9° | 173.5° |
| C21 | C20 | C15 | H19 | 64.6° | 53.5° |
| C20 | C21 | N6 | H30 | 179.0° | 179.6° |
| C21 | C20 | C23 | H34 | 126.9° | 142.9° |
| C21 | C20 | C23 | H33 | 112.1° | 93.4° |
| C21 | N6 | C22 | H30 | 180.0° | 180.0° |
| C21 | N6 | C22 | C23 | 5.8° | 17.0° |
| N6 | C21 | C20 | C23 | 4.2° | 16.2° |
| N6 | C21 | C20 | H29 | 111.7° | 135.0° |
| C21 | N6 | C22 | H32 | 113.4° | 136.0° |
| C21 | N6 | C22 | H31 | 124.9° | 102.0° |
| N6 | C22 | C23 | H32 | 119.2° | 119.0° |
| N6 | C22 | C23 | H31 | 119.1° | 119.1° |
| N6 | C22 | C23 | C20 | 7.9° | 25.4° |
| C22 | N6 | C21 | O5 | 177.4° | 179.6° |
| N6 | C22 | H32 | H31 | 122.5° | 122.0° |
| N6 | C22 | C23 | H34 | 127.4° | 143.5° |
| N6 | C22 | C23 | H33 | 111.6° | 92.7° |
| C22 | C23 | C20 | H34 | 119.5° | 118.2° |
| C22 | C23 | C20 | H33 | 119.5° | 118.2° |
| C22 | C23 | C20 | H29 | 108.6° | 143.5° |
| C23 | C22 | H32 | H31 | 122.5° | 122.0° |
| C23 | C22 | N6 | H30 | 174.2° | 163.0° |
| C22 | C23 | H34 | H33 | 121.5° | 123.9° |
| C23 | C20 | C21 | O5 | 172.2° | 163.7° |
| C23 | C20 | C15 | H20 | 174.2° | 58.8° |
| C23 | C20 | C15 | H19 | 53.7° | 61.2° |
| C20 | C23 | C22 | H32 | 111.2° | 144.4° |
| C20 | C23 | C22 | H31 | 127.0° | 93.7° |
| C20 | C23 | H34 | H33 | 121.5° | 123.7° |
| O5 | C21 | C20 | H29 | 71.8° | 44.9° |
| O5 | C21 | N6 | H30 | 2.6° | 0.4° |
| O6 | C16 | C17 | O7 | 154.1° | 6.7° |
| O6 | C16 | C14 | H18 | 110.8° | 175.8° |
| O7 | C17 | C16 | H21 | 114.4° | 126.8° |
| O7 | C17 | N5 | H22 | 0.0° | 4.9° |
| O7 | C17 | N5 | H23 | 180.0° | 175.0° |
| H6 | C7 | H4 | H5 | 120.0° | 119.9° |
| H9 | C8 | H8 | H7 | 120.0° | 120.1° |
| H13 | C10 | C11 | H14 | 172.5° | 175.0° |
| H13 | C10 | C11 | H15 | 68.4° | 65.0° |
| H16 | C13 | C11 | H14 | 59.4° | 90.7° |
| H16 | C13 | C11 | H15 | 178.5° | 149.4° |
| H16 | C13 | C18 | H26 | 3.7° | 0.0° |
| H16 | C13 | C18 | H25 | 145.0° | 145.1° |
| H16 | C13 | C19 | H28 | 3.8° | 145.1° |
| H16 | C13 | C19 | H27 | 145.0° | 0.1° |
| H20 | C15 | C20 | H29 | 62.2° | 63.9° |
| H20 | C15 | C14 | H18 | 163.8° | 65.0° |
| H19 | C15 | C20 | H29 | 177.3° | 176.1° |
| H19 | C15 | C14 | H18 | 75.6° | 175.0° |
| H29 | C20 | C23 | H34 | 10.9° | 98.3° |
| H29 | C20 | C23 | H33 | 131.9° | 25.4° |
| H32 | C22 | N6 | H30 | 66.6° | 44.0° |
| H32 | C22 | C23 | H34 | 8.2° | 97.5° |
| H32 | C22 | C23 | H33 | 129.3° | 26.3° |
| H31 | C22 | N6 | H30 | 55.1° | 78.0° |
| H31 | C22 | C23 | H34 | 113.5° | 24.4° |
| H31 | C22 | C23 | H33 | 7.5° | 148.2° |
| H11 | C9 | H10 | H12 | 120.0° | 120.0° |
| H17 | N4 | C14 | H18 | 166.7° | 143.6° |
| H18 | C14 | C16 | H21 | 19.2° | 64.1° |
| H21 | C16 | O6 | H35 | 88.4° | 60.0° |
| H26 | C18 | C19 | H28 | 0.0° | 145.0° |
| H26 | C18 | C19 | H27 | 141.2° | 0.0° |
| H25 | C18 | C19 | H28 | 141.2° | 0.0° |
| H25 | C18 | C19 | H27 | 0.0° | 145.0° |
