HAZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O6 | C25 | doub | 1.21Å | 1.31Å | |
| C25 | O5 | sing | 1.34Å | 1.24Å | |
| C25 | C24 | sing | 1.51Å | 1.53Å | |
| O5 | HO5 | sing | 0.97Å | 0.95Å | |
| C22 | C23 | sing | 1.53Å | 1.54Å | |
| C22 | C21 | sing | 1.51Å | 1.53Å | |
| C22 | H221 | sing | 1.09Å | 1.12Å | |
| C22 | H222 | sing | 1.09Å | 1.11Å | |
| C23 | C24 | sing | 1.53Å | 1.53Å | |
| C23 | H231 | sing | 1.09Å | 1.12Å | |
| C23 | H232 | sing | 1.09Å | 1.11Å | |
| C24 | H241 | sing | 1.09Å | 1.11Å | |
| C24 | H242 | sing | 1.09Å | 1.11Å | |
| C21 | O4 | doub | 1.21Å | 1.23Å | |
| C21 | N3 | sing | 1.35Å | 1.34Å | |
| N3 | C18 | sing | 1.40Å | 1.28Å | |
| N3 | HN3 | sing | 0.97Å | 1.02Å | |
| C15 | C16 | doub | 1.39Å | 1.41Å | Aromatic |
| C15 | C20 | sing | 1.39Å | 1.42Å | Aromatic |
| C15 | N2 | sing | 1.40Å | 1.29Å | |
| C16 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | H16 | sing | 1.08Å | 1.10Å | |
| C17 | C18 | doub | 1.39Å | 1.42Å | Aromatic |
| C17 | H17 | sing | 1.08Å | 1.10Å | |
| C18 | C19 | sing | 1.39Å | 1.41Å | Aromatic |
| C19 | C20 | doub | 1.38Å | 1.40Å | Aromatic |
| C19 | H19 | sing | 1.08Å | 1.10Å | |
| C20 | H20 | sing | 1.08Å | 1.10Å | |
| N2 | C14 | sing | 1.35Å | 1.34Å | |
| N2 | HN2 | sing | 0.97Å | 1.02Å | |
| C14 | O3 | doub | 1.21Å | 1.23Å | |
| C14 | C13 | sing | 1.51Å | 1.53Å | |
| C1 | C10 | sing | 1.53Å | 1.55Å | |
| C1 | C2 | sing | 1.53Å | 1.54Å | |
| C1 | H11 | sing | 1.09Å | 1.11Å | |
| C1 | H12 | sing | 1.09Å | 1.12Å | |
| C10 | C12 | sing | 1.53Å | 1.54Å | |
| C10 | C5 | sing | 1.52Å | 1.54Å | |
| C10 | C9 | sing | 1.53Å | 1.58Å | |
| C11 | C8 | sing | 1.53Å | 1.52Å | |
| C11 | H111 | sing | 1.09Å | 1.12Å | |
| C11 | H112 | sing | 1.09Å | 1.11Å | |
| C11 | H113 | sing | 1.09Å | 1.12Å | |
| C12 | H121 | sing | 1.09Å | 1.11Å | |
| C12 | H122 | sing | 1.09Å | 1.11Å | |
| C12 | H123 | sing | 1.09Å | 1.11Å | |
| C2 | C3 | sing | 1.52Å | 1.54Å | |
| C2 | H21 | sing | 1.09Å | 1.11Å | |
| C2 | H22 | sing | 1.10Å | 1.11Å | |
| C3 | N1 | sing | 1.47Å | 1.51Å | |
| C3 | H31 | sing | 1.09Å | 1.11Å | |
| C3 | H32 | sing | 1.09Å | 1.12Å | |
| O2 | N1 | sing | 1.48Å | 1.36Å | |
| C13 | N1 | sing | 1.47Å | 1.53Å | |
| C13 | H131 | sing | 1.09Å | 1.11Å | |
| C13 | H132 | sing | 1.09Å | 1.12Å | |
| N1 | C5 | sing | 1.45Å | 1.52Å | |
| C5 | C6 | sing | 1.53Å | 1.53Å | |
| C5 | H5 | sing | 1.12Å | 1.12Å | |
| C6 | C7 | sing | 1.53Å | 1.54Å | |
| C6 | H61 | sing | 1.10Å | 1.11Å | |
| C6 | H62 | sing | 1.08Å | 1.11Å | |
| C7 | C8 | sing | 1.53Å | 1.56Å | |
| C7 | H71 | sing | 1.09Å | 1.12Å | |
| C7 | H72 | sing | 1.09Å | 1.11Å | |
| C8 | C9 | sing | 1.52Å | 1.42Å | |
| C8 | O1 | sing | 1.44Å | 1.71Å | |
| C9 | O1 | sing | 1.42Å | 1.26Å | |
| C9 | H9 | sing | 1.09Å | 1.11Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O6 | C25 | O5 | 125.9° | 120.0° |
| O6 | C25 | C24 | 112.8° | 120.0° |
| O5 | C25 | C24 | 121.3° | 120.0° |
| C25 | O5 | HO5 | 125.8° | 120.0° |
| C25 | C24 | C23 | 112.5° | 109.5° |
| C25 | C24 | H241 | 111.1° | 109.5° |
| C25 | C24 | H242 | 111.2° | 109.5° |
| C23 | C22 | C21 | 112.1° | 109.5° |
| C23 | C22 | H221 | 111.3° | 109.5° |
| C23 | C22 | H222 | 111.3° | 109.5° |
| C22 | C23 | C24 | 112.7° | 109.5° |
| C22 | C23 | H231 | 111.0° | 109.5° |
| C22 | C23 | H232 | 111.0° | 109.5° |
| C21 | C22 | H221 | 111.2° | 109.5° |
| C21 | C22 | H222 | 111.2° | 109.5° |
| C22 | C21 | O4 | 120.7° | 120.0° |
| C22 | C21 | N3 | 116.8° | 120.0° |
| H221 | C22 | H222 | 99.1° | 109.4° |
| C24 | C23 | H231 | 111.1° | 109.5° |
| C24 | C23 | H232 | 111.1° | 109.5° |
| C23 | C24 | H241 | 111.1° | 109.4° |
| C23 | C24 | H242 | 111.0° | 109.4° |
| H231 | C23 | H232 | 99.3° | 109.5° |
| H241 | C24 | H242 | 99.2° | 109.5° |
| O4 | C21 | N3 | 122.4° | 119.9° |
| C21 | N3 | C18 | 131.4° | 120.0° |
| C21 | N3 | HN3 | 117.3° | 120.0° |
| C18 | N3 | HN3 | 111.3° | 120.0° |
| N3 | C18 | C17 | 120.2° | 120.0° |
| N3 | C18 | C19 | 119.5° | 120.0° |
| C16 | C15 | C20 | 119.8° | 120.0° |
| C16 | C15 | N2 | 119.7° | 120.0° |
| C15 | C16 | C17 | 119.8° | 120.0° |
| C15 | C16 | H16 | 120.7° | 120.0° |
| C20 | C15 | N2 | 120.6° | 120.0° |
| C15 | C20 | C19 | 120.3° | 120.0° |
| C15 | C20 | H20 | 120.7° | 120.0° |
| C15 | N2 | C14 | 131.7° | 120.0° |
| C15 | N2 | HN2 | 111.7° | 120.0° |
| C17 | C16 | H16 | 119.6° | 120.0° |
| C16 | C17 | C18 | 120.2° | 120.0° |
| C16 | C17 | H17 | 119.1° | 120.0° |
| C18 | C17 | H17 | 120.8° | 120.0° |
| C17 | C18 | C19 | 120.3° | 120.0° |
| C18 | C19 | C20 | 119.7° | 120.0° |
| C18 | C19 | H19 | 120.4° | 120.0° |
| C20 | C19 | H19 | 119.9° | 120.0° |
| C19 | C20 | H20 | 118.9° | 120.0° |
| C14 | N2 | HN2 | 116.5° | 120.0° |
| N2 | C14 | O3 | 122.5° | 120.1° |
| N2 | C14 | C13 | 116.5° | 119.9° |
| O3 | C14 | C13 | 121.0° | 120.0° |
| C14 | C13 | N1 | 114.9° | 109.4° |
| C14 | C13 | H131 | 110.3° | 109.5° |
| C14 | C13 | H132 | 110.3° | 109.5° |
| C10 | C1 | C2 | 114.3° | 109.1° |
| C10 | C1 | H11 | 110.4° | 109.5° |
| C10 | C1 | H12 | 110.4° | 109.4° |
| C1 | C10 | C12 | 114.5° | 108.8° |
| C1 | C10 | C5 | 107.4° | 110.2° |
| C1 | C10 | C9 | 108.9° | 109.4° |
| C2 | C1 | H11 | 110.5° | 109.8° |
| C2 | C1 | H12 | 110.5° | 109.6° |
| C1 | C2 | C3 | 111.7° | 109.8° |
| C1 | C2 | H21 | 111.4° | 110.7° |
| C1 | C2 | H22 | 111.3° | 108.6° |
| H11 | C1 | H12 | 99.8° | 109.4° |
| C12 | C10 | C5 | 113.1° | 112.9° |
| C12 | C10 | C9 | 103.7° | 106.8° |
| C10 | C12 | H121 | 114.5° | 109.5° |
| C10 | C12 | H122 | 110.3° | 109.4° |
| C10 | C12 | H123 | 110.3° | 109.5° |
| C5 | C10 | C9 | 109.1° | 108.7° |
| C10 | C5 | N1 | 118.1° | 116.7° |
| C10 | C5 | C6 | 107.8° | 110.1° |
| C10 | C5 | H5 | 105.6° | 105.8° |
| C10 | C9 | C8 | 121.1° | 118.7° |
| C10 | C9 | O1 | 116.0° | 120.3° |
| C10 | C9 | H9 | 92.1° | 114.3° |
| C8 | C11 | H111 | 125.0° | 109.5° |
| C8 | C11 | H112 | 106.8° | 109.5° |
| C8 | C11 | H113 | 106.8° | 109.5° |
| C11 | C8 | C7 | 124.9° | 115.4° |
| C11 | C8 | C9 | 115.8° | 117.4° |
| C11 | C8 | O1 | 102.3° | 117.1° |
| H111 | C11 | H112 | 106.7° | 109.4° |
| H111 | C11 | H113 | 106.7° | 109.5° |
| H112 | C11 | H113 | 102.8° | 109.5° |
| H121 | C12 | H122 | 110.4° | 109.5° |
| H121 | C12 | H123 | 110.4° | 109.5° |
| H122 | C12 | H123 | 99.9° | 109.4° |
| C3 | C2 | H21 | 111.4° | 110.8° |
| C3 | C2 | H22 | 111.4° | 108.9° |
| C2 | C3 | N1 | 114.5° | 112.1° |
| C2 | C3 | H31 | 110.3° | 109.2° |
| C2 | C3 | H32 | 110.4° | 109.2° |
| H21 | C2 | H22 | 99.0° | 108.1° |
| N1 | C3 | H31 | 110.4° | 109.0° |
| N1 | C3 | H32 | 110.4° | 109.0° |
| C3 | N1 | O2 | 104.8° | 106.6° |
| C3 | N1 | C13 | 114.6° | 110.2° |
| C3 | N1 | C5 | 109.5° | 112.1° |
| H31 | C3 | H32 | 99.9° | 108.2° |
| O2 | N1 | C13 | 105.9° | 106.7° |
| O2 | N1 | C5 | 104.9° | 107.3° |
| N1 | C13 | H131 | 110.2° | 109.5° |
| N1 | C13 | H132 | 110.2° | 109.4° |
| C13 | N1 | C5 | 116.0° | 113.4° |
| H131 | C13 | H132 | 100.0° | 109.5° |
| N1 | C5 | C6 | 112.4° | 112.6° |
| N1 | C5 | H5 | 100.3° | 105.5° |
| C6 | C5 | H5 | 112.3° | 105.1° |
| C5 | C6 | C7 | 110.1° | 108.0° |
| C5 | C6 | H61 | 112.0° | 109.1° |
| C5 | C6 | H62 | 111.9° | 112.3° |
| C7 | C6 | H61 | 111.9° | 108.4° |
| C7 | C6 | H62 | 111.9° | 110.0° |
| C6 | C7 | C8 | 115.9° | 111.0° |
| C6 | C7 | H71 | 109.9° | 109.1° |
| C6 | C7 | H72 | 109.9° | 109.0° |
| H61 | C6 | H62 | 98.5° | 109.0° |
| C8 | C7 | H71 | 109.8° | 109.4° |
| C8 | C7 | H72 | 109.9° | 109.3° |
| C7 | C8 | C9 | 118.8° | 121.7° |
| C7 | C8 | O1 | 119.9° | 115.2° |
| H71 | C7 | H72 | 100.3° | 109.1° |
| C9 | C8 | O1 | 46.5° | 57.1° |
| C8 | C9 | O1 | 78.8° | 58.5° |
| C8 | C9 | H9 | 123.9° | 116.8° |
| C8 | O1 | C9 | 54.7° | 64.3° |
| O1 | C9 | H9 | 128.4° | 117.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O6 | C25 | O5 | C24 | 179.8° | 179.9° |
| O6 | C25 | O5 | HO5 | 180.0° | 0.1° |
| O6 | C25 | C24 | C23 | 139.6° | 0.0° |
| O6 | C25 | C24 | H241 | 14.3° | 120.0° |
| O6 | C25 | C24 | H242 | 95.2° | 119.9° |
| O5 | C25 | C24 | C23 | 40.2° | 180.0° |
| O5 | C25 | C24 | H241 | 165.5° | 60.0° |
| O5 | C25 | C24 | H242 | 85.0° | 60.0° |
| C24 | C25 | O5 | HO5 | 0.2° | 180.0° |
| C25 | C24 | C23 | C22 | 179.8° | 180.0° |
| C25 | C24 | C23 | H241 | 125.3° | 120.0° |
| C25 | C24 | C23 | H242 | 125.3° | 120.0° |
| C25 | C24 | C23 | H231 | 55.0° | 60.0° |
| C25 | C24 | C23 | H232 | 54.5° | 60.0° |
| C25 | C24 | H241 | H242 | 117.1° | 120.1° |
| C23 | C22 | C21 | H221 | 125.3° | 120.0° |
| C23 | C22 | C21 | H222 | 125.3° | 120.0° |
| C23 | C22 | H221 | H222 | 117.2° | 120.0° |
| C22 | C23 | C24 | H231 | 125.3° | 120.0° |
| C22 | C23 | C24 | H232 | 125.3° | 120.0° |
| C22 | C23 | H231 | H232 | 116.8° | 120.0° |
| C22 | C23 | C24 | H241 | 54.9° | 60.0° |
| C22 | C23 | C24 | H242 | 54.5° | 60.0° |
| C23 | C22 | C21 | O4 | 36.1° | 0.0° |
| C23 | C22 | C21 | N3 | 143.9° | 180.0° |
| C21 | C22 | H221 | H222 | 117.1° | 120.0° |
| C21 | C22 | C23 | C24 | 179.5° | 180.0° |
| C21 | C22 | C23 | H231 | 54.2° | 60.0° |
| C21 | C22 | C23 | H232 | 55.2° | 60.0° |
| C22 | C21 | O4 | N3 | 180.0° | 180.0° |
| C22 | C21 | N3 | C18 | 179.9° | 174.3° |
| C22 | C21 | N3 | HN3 | 0.1° | 5.8° |
| H221 | C22 | C23 | C24 | 54.3° | 60.0° |
| H221 | C22 | C23 | H231 | 71.0° | 180.0° |
| H221 | C22 | C23 | H232 | 179.6° | 60.0° |
| H221 | C22 | C21 | O4 | 89.2° | 120.0° |
| H221 | C22 | C21 | N3 | 90.9° | 60.0° |
| H222 | C22 | C23 | C24 | 55.2° | 60.0° |
| H222 | C22 | C23 | H231 | 179.5° | 60.0° |
| H222 | C22 | C23 | H232 | 70.1° | 180.0° |
| H222 | C22 | C21 | O4 | 161.4° | 120.0° |
| H222 | C22 | C21 | N3 | 18.6° | 59.9° |
| C24 | C23 | H231 | H232 | 116.9° | 120.0° |
| C23 | C24 | H241 | H242 | 116.9° | 119.9° |
| H231 | C23 | C24 | H241 | 70.3° | 180.0° |
| H231 | C23 | C24 | H242 | 179.7° | 60.0° |
| H232 | C23 | C24 | H241 | 179.8° | 60.0° |
| H232 | C23 | C24 | H242 | 70.8° | 180.0° |
| O4 | C21 | N3 | C18 | 0.1° | 5.6° |
| O4 | C21 | N3 | HN3 | 179.9° | 174.3° |
| C21 | N3 | C18 | HN3 | 180.0° | 179.9° |
| C21 | N3 | C18 | C17 | 17.3° | 145.4° |
| C21 | N3 | C18 | C19 | 162.6° | 34.6° |
| N3 | C18 | C17 | C16 | 179.8° | 180.0° |
| N3 | C18 | C17 | C19 | 179.9° | 180.0° |
| N3 | C18 | C17 | H17 | 0.2° | 0.0° |
| N3 | C18 | C19 | C20 | 179.8° | 179.8° |
| N3 | C18 | C19 | H19 | 0.2° | 0.0° |
| HN3 | N3 | C18 | C17 | 162.7° | 34.5° |
| HN3 | N3 | C18 | C19 | 17.4° | 145.5° |
| C16 | C15 | C20 | N2 | 179.3° | 179.7° |
| C15 | C16 | C17 | H16 | 180.0° | 180.0° |
| C15 | C16 | C17 | C18 | 0.1° | 0.0° |
| C15 | C16 | C17 | H17 | 179.9° | 180.0° |
| C16 | C15 | C20 | C19 | 0.2° | 0.4° |
| C16 | C15 | C20 | H20 | 179.8° | 179.9° |
| C16 | C15 | N2 | C14 | 174.2° | 35.2° |
| C16 | C15 | N2 | HN2 | 5.8° | 144.9° |
| C20 | C15 | C16 | C17 | 0.1° | 0.3° |
| C20 | C15 | C16 | H16 | 179.8° | 179.8° |
| C15 | C20 | C19 | C18 | 0.1° | 0.4° |
| C15 | C20 | C19 | H20 | 180.0° | 179.6° |
| C15 | C20 | C19 | H19 | 179.9° | 179.8° |
| C20 | C15 | N2 | C14 | 5.2° | 145.1° |
| C20 | C15 | N2 | HN2 | 174.9° | 34.8° |
| N2 | C15 | C16 | C17 | 179.5° | 180.0° |
| N2 | C15 | C16 | H16 | 0.5° | 0.0° |
| N2 | C15 | C20 | C19 | 179.5° | 179.8° |
| N2 | C15 | C20 | H20 | 0.5° | 0.2° |
| C15 | N2 | C14 | HN2 | 180.0° | 179.9° |
| C15 | N2 | C14 | O3 | 0.0° | 4.4° |
| C15 | N2 | C14 | C13 | 178.3° | 175.7° |
| C16 | C17 | C18 | H17 | 180.0° | 180.0° |
| C16 | C17 | C18 | C19 | 0.1° | 0.0° |
| H16 | C16 | C17 | C18 | 179.9° | 180.0° |
| H16 | C16 | C17 | H17 | 0.1° | 0.0° |
| C17 | C18 | C19 | C20 | 0.1° | 0.1° |
| C17 | C18 | C19 | H19 | 179.9° | 180.0° |
| H17 | C17 | C18 | C19 | 179.9° | 180.0° |
| C18 | C19 | C20 | H19 | 180.0° | 179.8° |
| C18 | C19 | C20 | H20 | 179.9° | 180.0° |
| H19 | C19 | C20 | H20 | 0.1° | 0.2° |
| N2 | C14 | O3 | C13 | 178.2° | 180.0° |
| N2 | C14 | C13 | N1 | 115.9° | 174.9° |
| N2 | C14 | C13 | H131 | 118.9° | 65.1° |
| N2 | C14 | C13 | H132 | 9.4° | 54.9° |
| HN2 | N2 | C14 | O3 | 180.0° | 175.8° |
| HN2 | N2 | C14 | C13 | 1.7° | 4.2° |
| O3 | C14 | C13 | N1 | 62.5° | 5.2° |
| O3 | C14 | C13 | H131 | 62.8° | 114.8° |
| O3 | C14 | C13 | H132 | 172.3° | 125.1° |
| C14 | C13 | N1 | C3 | 72.5° | 63.3° |
| C14 | C13 | N1 | O2 | 42.4° | 52.1° |
| C14 | C13 | N1 | H131 | 125.3° | 120.1° |
| C14 | C13 | N1 | H132 | 125.3° | 120.0° |
| C14 | C13 | H131 | H132 | 116.1° | 120.0° |
| C14 | C13 | N1 | C5 | 158.4° | 170.1° |
| C10 | C1 | C2 | H11 | 125.2° | 120.0° |
| C10 | C1 | C2 | H12 | 125.2° | 119.8° |
| C10 | C1 | H11 | H12 | 116.3° | 119.9° |
| C1 | C10 | C12 | C5 | 123.4° | 122.7° |
| C1 | C10 | C12 | C9 | 118.5° | 118.0° |
| C1 | C10 | C5 | C9 | 117.9° | 119.9° |
| C1 | C10 | C12 | H121 | 180.0° | 177.4° |
| C1 | C10 | C12 | H122 | 54.7° | 62.6° |
| C1 | C10 | C12 | H123 | 54.7° | 57.3° |
| C10 | C1 | C2 | C3 | 51.9° | 58.7° |
| C10 | C1 | C2 | H21 | 73.4° | 63.8° |
| C10 | C1 | C2 | H22 | 177.2° | 177.6° |
| C1 | C10 | C5 | N1 | 52.6° | 50.0° |
| C1 | C10 | C5 | C6 | 178.7° | 179.9° |
| C1 | C10 | C5 | H5 | 58.5° | 66.9° |
| C1 | C10 | C9 | C8 | 149.6° | 147.7° |
| C1 | C10 | C9 | O1 | 57.3° | 79.4° |
| C1 | C10 | C9 | H9 | 78.0° | 68.0° |
| C2 | C1 | H11 | H12 | 116.3° | 120.3° |
| C2 | C1 | C10 | C12 | 76.0° | 70.9° |
| C2 | C1 | C10 | C5 | 50.4° | 53.3° |
| C2 | C1 | C10 | C9 | 168.5° | 172.7° |
| C1 | C2 | C3 | H21 | 125.3° | 122.5° |
| C1 | C2 | C3 | H22 | 125.2° | 118.8° |
| C1 | C2 | H21 | H22 | 117.2° | 118.9° |
| C1 | C2 | C3 | N1 | 51.4° | 58.9° |
| C1 | C2 | C3 | H31 | 176.7° | 179.8° |
| C1 | C2 | C3 | H32 | 73.9° | 62.0° |
| H11 | C1 | C10 | C12 | 49.3° | 49.2° |
| H11 | C1 | C10 | C5 | 175.7° | 173.5° |
| H11 | C1 | C10 | C9 | 66.3° | 67.1° |
| H11 | C1 | C2 | C3 | 177.1° | 178.7° |
| H11 | C1 | C2 | H21 | 51.8° | 56.1° |
| H11 | C1 | C2 | H22 | 57.6° | 62.4° |
| H12 | C1 | C10 | C12 | 158.7° | 169.1° |
| H12 | C1 | C10 | C5 | 74.8° | 66.7° |
| H12 | C1 | C10 | C9 | 43.2° | 52.8° |
| H12 | C1 | C2 | C3 | 73.4° | 61.1° |
| H12 | C1 | C2 | H21 | 161.3° | 176.3° |
| H12 | C1 | C2 | H22 | 51.9° | 57.8° |
| C12 | C10 | C5 | C9 | 114.8° | 118.2° |
| C10 | C12 | H121 | H122 | 125.2° | 120.0° |
| C10 | C12 | H121 | H123 | 125.2° | 120.0° |
| C10 | C12 | H122 | H123 | 116.2° | 120.0° |
| C12 | C10 | C5 | N1 | 74.7° | 71.8° |
| C12 | C10 | C5 | C6 | 54.0° | 58.2° |
| C12 | C10 | C5 | H5 | 174.2° | 171.3° |
| C12 | C10 | C9 | C8 | 88.0° | 94.7° |
| C12 | C10 | C9 | O1 | 179.6° | 163.0° |
| C12 | C10 | C9 | H9 | 44.3° | 49.6° |
| C5 | C10 | C12 | H121 | 56.6° | 54.7° |
| C5 | C10 | C12 | H122 | 178.2° | 174.7° |
| C5 | C10 | C12 | H123 | 68.7° | 65.3° |
| C10 | C5 | N1 | C3 | 53.0° | 49.4° |
| C10 | C5 | N1 | O2 | 165.0° | 166.2° |
| C10 | C5 | N1 | C13 | 78.5° | 76.2° |
| C10 | C5 | N1 | C6 | 126.5° | 128.8° |
| C10 | C5 | N1 | H5 | 114.0° | 117.0° |
| C10 | C5 | C6 | H5 | 115.9° | 113.5° |
| C10 | C5 | C6 | C7 | 66.9° | 74.1° |
| C10 | C5 | C6 | H61 | 58.4° | 168.4° |
| C10 | C5 | C6 | H62 | 167.9° | 47.4° |
| C5 | C10 | C9 | C8 | 32.7° | 27.3° |
| C5 | C10 | C9 | O1 | 59.7° | 41.0° |
| C5 | C10 | C9 | H9 | 165.1° | 171.6° |
| C10 | C9 | C8 | C11 | 163.9° | 144.2° |
| C9 | C10 | C12 | H121 | 61.5° | 64.6° |
| C9 | C10 | C12 | H122 | 63.8° | 55.4° |
| C9 | C10 | C12 | H123 | 173.3° | 175.3° |
| C9 | C10 | C5 | N1 | 170.5° | 169.9° |
| C9 | C10 | C5 | C6 | 60.8° | 60.1° |
| C9 | C10 | C5 | H5 | 59.4° | 53.0° |
| C10 | C9 | C8 | C7 | 8.4° | 8.5° |
| C10 | C9 | C8 | O1 | 113.7° | 109.8° |
| C10 | C9 | C8 | H9 | 117.2° | 143.4° |
| C10 | C9 | O1 | H9 | 116.1° | 146.6° |
| C8 | C11 | H111 | H112 | 125.4° | 120.0° |
| C8 | C11 | H111 | H113 | 125.2° | 120.0° |
| C8 | C11 | H112 | H113 | 112.2° | 120.1° |
| C11 | C8 | C7 | C6 | 159.0° | 133.5° |
| C11 | C8 | C7 | C9 | 171.6° | 153.2° |
| C11 | C8 | C7 | O1 | 134.5° | 141.3° |
| C11 | C8 | C7 | H71 | 33.7° | 106.0° |
| C11 | C8 | C7 | H72 | 75.8° | 13.3° |
| C11 | C8 | C9 | O1 | 82.4° | 106.0° |
| C11 | C8 | C9 | H9 | 46.7° | 0.8° |
| H111 | C11 | H112 | H113 | 112.1° | 120.0° |
| H111 | C11 | C8 | C7 | 179.9° | 34.4° |
| H111 | C11 | C8 | C9 | 8.2° | 171.2° |
| H111 | C11 | C8 | O1 | 39.1° | 106.1° |
| H112 | C11 | C8 | C7 | 54.7° | 154.4° |
| H112 | C11 | C8 | C9 | 117.1° | 51.3° |
| H112 | C11 | C8 | O1 | 164.5° | 13.8° |
| H113 | C11 | C8 | C7 | 54.7° | 85.6° |
| H113 | C11 | C8 | C9 | 133.4° | 68.8° |
| H113 | C11 | C8 | O1 | 86.1° | 133.9° |
| H121 | C12 | H122 | H123 | 116.3° | 120.0° |
| C3 | C2 | H21 | H22 | 117.3° | 119.2° |
| C2 | C3 | N1 | H31 | 125.3° | 121.0° |
| C2 | C3 | N1 | H32 | 125.2° | 121.0° |
| C2 | C3 | H31 | H32 | 116.2° | 118.8° |
| C2 | C3 | N1 | O2 | 162.3° | 170.0° |
| C2 | C3 | N1 | C13 | 82.1° | 74.5° |
| C2 | C3 | N1 | C5 | 50.2° | 52.8° |
| H21 | C2 | C3 | N1 | 73.9° | 63.6° |
| H21 | C2 | C3 | H31 | 51.4° | 57.3° |
| H21 | C2 | C3 | H32 | 160.8° | 175.5° |
| H22 | C2 | C3 | N1 | 176.6° | 177.7° |
| H22 | C2 | C3 | H31 | 58.1° | 61.4° |
| H22 | C2 | C3 | H32 | 51.3° | 56.8° |
| N1 | C3 | H31 | H32 | 116.3° | 118.4° |
| C3 | N1 | O2 | C13 | 121.5° | 117.8° |
| C3 | N1 | O2 | C5 | 115.3° | 120.3° |
| C3 | N1 | C13 | C5 | 129.1° | 126.6° |
| C3 | N1 | C13 | H131 | 52.8° | 176.7° |
| C3 | N1 | C13 | H132 | 162.2° | 56.7° |
| C3 | N1 | C5 | C6 | 179.6° | 178.2° |
| C3 | N1 | C5 | H5 | 61.0° | 67.6° |
| H31 | C3 | N1 | O2 | 72.5° | 68.9° |
| H31 | C3 | N1 | C13 | 43.2° | 46.5° |
| H31 | C3 | N1 | C5 | 175.4° | 173.9° |
| H32 | C3 | N1 | O2 | 37.0° | 49.0° |
| H32 | C3 | N1 | C13 | 152.7° | 164.4° |
| H32 | C3 | N1 | C5 | 75.1° | 68.2° |
| O2 | N1 | C13 | C5 | 115.9° | 118.0° |
| O2 | N1 | C13 | H131 | 167.7° | 67.9° |
| O2 | N1 | C13 | H132 | 82.9° | 172.1° |
| O2 | N1 | C5 | C6 | 68.5° | 65.0° |
| O2 | N1 | C5 | H5 | 51.0° | 49.1° |
| N1 | C13 | H131 | H132 | 116.0° | 120.0° |
| C13 | N1 | C5 | C6 | 48.0° | 52.6° |
| C13 | N1 | C5 | H5 | 167.5° | 166.7° |
| H131 | C13 | N1 | C5 | 76.4° | 50.0° |
| H132 | C13 | N1 | C5 | 33.1° | 69.9° |
| N1 | C5 | C6 | H5 | 112.2° | 114.4° |
| N1 | C5 | C6 | C7 | 161.2° | 153.8° |
| N1 | C5 | C6 | H61 | 73.5° | 36.2° |
| N1 | C5 | C6 | H62 | 36.0° | 84.8° |
| C5 | C6 | C7 | H61 | 125.2° | 118.0° |
| C5 | C6 | C7 | H62 | 125.2° | 122.9° |
| C5 | C6 | H61 | H62 | 117.9° | 123.0° |
| C5 | C6 | C7 | C8 | 41.7° | 49.6° |
| C5 | C6 | C7 | H71 | 167.0° | 71.0° |
| C5 | C6 | C7 | H72 | 83.5° | 170.0° |
| H5 | C5 | C6 | C7 | 49.0° | 39.4° |
| H5 | C5 | C6 | H61 | 174.2° | 78.1° |
| H5 | C5 | C6 | H62 | 76.2° | 160.9° |
| C7 | C6 | H61 | H62 | 117.9° | 119.7° |
| C6 | C7 | C8 | H71 | 125.3° | 120.4° |
| C6 | C7 | C8 | H72 | 125.3° | 120.2° |
| C6 | C7 | H71 | H72 | 115.7° | 118.9° |
| C6 | C7 | C8 | C9 | 12.6° | 19.6° |
| C6 | C7 | C8 | O1 | 66.5° | 85.2° |
| H61 | C6 | C7 | C8 | 83.5° | 167.6° |
| H61 | C6 | C7 | H71 | 41.7° | 47.1° |
| H61 | C6 | C7 | H72 | 151.2° | 72.0° |
| H62 | C6 | C7 | C8 | 167.0° | 73.3° |
| H62 | C6 | C7 | H71 | 67.8° | 166.2° |
| H62 | C6 | C7 | H72 | 41.7° | 47.1° |
| C8 | C7 | H71 | H72 | 115.6° | 119.5° |
| C7 | C8 | C9 | O1 | 105.3° | 101.4° |
| C7 | C8 | C9 | H9 | 125.7° | 151.8° |
| H71 | C7 | C8 | C9 | 137.9° | 100.8° |
| H71 | C7 | C8 | O1 | 168.2° | 35.2° |
| H72 | C7 | C8 | C9 | 112.7° | 139.8° |
| H72 | C7 | C8 | O1 | 58.8° | 154.6° |
| C8 | C9 | O1 | H9 | 124.6° | 106.3° |
