ZGW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O9 | C8 | doub | 1.21Å | 1.24Å | |
| C8 | N7 | sing | 1.34Å | 1.35Å | |
| C8 | C4 | sing | 1.51Å | 1.53Å | |
| N7 | C6 | sing | 1.47Å | 1.46Å | |
| F34 | C32 | sing | 1.40Å | 1.35Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C3 | C2 | sing | 1.53Å | 1.54Å | |
| C4 | C5 | sing | 1.55Å | 1.55Å | |
| N31 | C1 | trip | 1.14Å | 1.16Å | |
| C1 | C2 | sing | 1.47Å | 1.47Å | |
| C2 | N10 | sing | 1.46Å | 1.47Å | |
| N10 | C11 | sing | 1.35Å | 1.36Å | |
| C32 | F33 | sing | 1.40Å | 1.35Å | |
| C32 | F35 | sing | 1.40Å | 1.35Å | |
| C32 | C21 | sing | 1.51Å | 1.54Å | |
| C6 | C5 | sing | 1.54Å | 1.54Å | |
| O23 | C14 | doub | 1.21Å | 1.25Å | |
| C28 | C26 | sing | 1.53Å | 1.52Å | |
| C12 | C11 | sing | 1.51Å | 1.54Å | |
| C12 | C29 | sing | 1.54Å | 1.53Å | |
| C12 | N13 | sing | 1.48Å | 1.48Å | |
| C11 | O30 | doub | 1.21Å | 1.24Å | |
| N20 | C21 | sing | 1.35Å | 1.33Å | |
| N20 | C15 | sing | 1.46Å | 1.47Å | |
| C14 | N13 | sing | 1.35Å | 1.35Å | |
| C14 | C15 | sing | 1.51Å | 1.54Å | |
| C21 | O22 | doub | 1.21Å | 1.23Å | |
| C26 | C29 | sing | 1.53Å | 1.52Å | |
| C26 | C27 | sing | 1.53Å | 1.52Å | |
| C26 | C25 | sing | 1.53Å | 1.52Å | |
| C29 | C25 | sing | 1.54Å | 1.52Å | |
| N13 | C24 | sing | 1.48Å | 1.48Å | |
| C17 | C16 | sing | 1.53Å | 1.54Å | |
| C15 | C16 | sing | 1.53Å | 1.57Å | |
| C25 | C24 | sing | 1.54Å | 1.51Å | |
| C16 | C19 | sing | 1.53Å | 1.54Å | |
| C16 | C18 | sing | 1.53Å | 1.54Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C3 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| C6 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.09Å | 1.10Å | |
| C19 | H17 | sing | 1.09Å | 1.10Å | |
| C19 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C24 | H20 | sing | 1.09Å | 1.10Å | |
| C24 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| C27 | H23 | sing | 1.09Å | 1.10Å | |
| C27 | H24 | sing | 1.09Å | 1.10Å | |
| C27 | H25 | sing | 1.09Å | 1.10Å | |
| C28 | H26 | sing | 1.09Å | 1.10Å | |
| C28 | H27 | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| N10 | H30 | sing | 0.97Å | 1.00Å | |
| N20 | H31 | sing | 0.97Å | 1.00Å | |
| N7 | H32 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O9 | C8 | N7 | 126.4° | 125.0° |
| O9 | C8 | C4 | 125.3° | 125.0° |
| N7 | C8 | C4 | 108.2° | 110.1° |
| C8 | N7 | C6 | 113.7° | 111.3° |
| C8 | N7 | H32 | 123.2° | 124.3° |
| C8 | C4 | C3 | 110.1° | 110.5° |
| C8 | C4 | C5 | 103.7° | 104.2° |
| C8 | C4 | H4 | 108.3° | 110.6° |
| N7 | C6 | C5 | 102.1° | 105.5° |
| N7 | C6 | H7 | 111.3° | 110.3° |
| N7 | C6 | H8 | 111.3° | 110.3° |
| C6 | N7 | H32 | 123.1° | 124.4° |
| F34 | C32 | F33 | 107.9° | 109.5° |
| F34 | C32 | F35 | 108.0° | 109.5° |
| F34 | C32 | C21 | 109.7° | 109.5° |
| C4 | C3 | C2 | 113.9° | 109.5° |
| C3 | C4 | C5 | 118.0° | 110.5° |
| C4 | C3 | H2 | 108.3° | 109.5° |
| C4 | C3 | H3 | 108.4° | 109.4° |
| C3 | C4 | H4 | 108.3° | 110.4° |
| C3 | C2 | C1 | 111.8° | 109.5° |
| C3 | C2 | N10 | 114.1° | 109.5° |
| C3 | C2 | H1 | 106.5° | 109.5° |
| C2 | C3 | H2 | 108.4° | 109.5° |
| C2 | C3 | H3 | 108.3° | 109.5° |
| C4 | C5 | C6 | 104.4° | 101.8° |
| C5 | C4 | H4 | 108.1° | 110.5° |
| C4 | C5 | H5 | 110.7° | 111.0° |
| C4 | C5 | H6 | 110.7° | 111.0° |
| N31 | C1 | C2 | 178.8° | 180.0° |
| C1 | C2 | N10 | 109.6° | 109.5° |
| C1 | C2 | H1 | 107.3° | 109.4° |
| C2 | N10 | C11 | 125.4° | 120.0° |
| N10 | C2 | H1 | 107.3° | 109.5° |
| C2 | N10 | H30 | 117.3° | 120.1° |
| N10 | C11 | C12 | 119.7° | 120.0° |
| N10 | C11 | O30 | 119.9° | 120.0° |
| C11 | N10 | H30 | 117.3° | 120.0° |
| F33 | C32 | F35 | 108.3° | 109.5° |
| F33 | C32 | C21 | 109.6° | 109.5° |
| F35 | C32 | C21 | 113.2° | 109.4° |
| C32 | C21 | N20 | 115.6° | 120.0° |
| C32 | C21 | O22 | 118.3° | 120.0° |
| C6 | C5 | H5 | 110.7° | 111.0° |
| C6 | C5 | H6 | 110.7° | 111.0° |
| C5 | C6 | H7 | 111.3° | 110.3° |
| C5 | C6 | H8 | 111.3° | 110.2° |
| O23 | C14 | N13 | 121.2° | 120.0° |
| O23 | C14 | C15 | 120.7° | 120.0° |
| C28 | C26 | C29 | 121.7° | 117.5° |
| C28 | C26 | C27 | 113.0° | 115.5° |
| C28 | C26 | C25 | 121.6° | 117.4° |
| C26 | C28 | H26 | 109.5° | 109.5° |
| C26 | C28 | H27 | 109.5° | 109.5° |
| C26 | C28 | H28 | 109.5° | 109.4° |
| C11 | C12 | C29 | 108.8° | 110.5° |
| C11 | C12 | N13 | 109.5° | 110.4° |
| C12 | C11 | O30 | 120.3° | 120.1° |
| C11 | C12 | H9 | 110.9° | 110.4° |
| C29 | C12 | N13 | 104.5° | 104.6° |
| C12 | C29 | C26 | 119.4° | 118.2° |
| C12 | C29 | C25 | 108.0° | 105.0° |
| C29 | C12 | H9 | 111.0° | 110.4° |
| C12 | C29 | H29 | 118.2° | 117.6° |
| C12 | N13 | C14 | 118.6° | 127.9° |
| C12 | N13 | C24 | 113.8° | 104.3° |
| N13 | C12 | H9 | 111.8° | 110.5° |
| C21 | N20 | C15 | 120.9° | 120.0° |
| N20 | C21 | O22 | 126.1° | 120.0° |
| C21 | N20 | H31 | 119.6° | 120.1° |
| N20 | C15 | C14 | 108.9° | 109.5° |
| N20 | C15 | C16 | 111.6° | 109.5° |
| N20 | C15 | H10 | 107.9° | 109.5° |
| C15 | N20 | H31 | 119.5° | 119.9° |
| N13 | C14 | C15 | 118.1° | 120.0° |
| C14 | N13 | C24 | 127.4° | 127.8° |
| C14 | C15 | C16 | 114.4° | 109.5° |
| C14 | C15 | H10 | 107.0° | 109.4° |
| C29 | C26 | C27 | 115.5° | 117.5° |
| C29 | C26 | C25 | 59.9° | 60.6° |
| C26 | C29 | C25 | 59.8° | 59.7° |
| C26 | C29 | H29 | 118.4° | 119.5° |
| C27 | C26 | C25 | 115.4° | 117.4° |
| C26 | C27 | H23 | 109.5° | 109.4° |
| C26 | C27 | H24 | 109.5° | 109.5° |
| C26 | C27 | H25 | 109.4° | 109.5° |
| C26 | C25 | C29 | 60.2° | 59.7° |
| C26 | C25 | C24 | 119.0° | 118.1° |
| C26 | C25 | H22 | 118.2° | 119.5° |
| C29 | C25 | C24 | 108.9° | 105.0° |
| C29 | C25 | H22 | 118.1° | 123.1° |
| C25 | C29 | H29 | 118.5° | 123.1° |
| N13 | C24 | C25 | 104.6° | 104.6° |
| N13 | C24 | H20 | 110.7° | 112.1° |
| N13 | C24 | H21 | 110.7° | 108.9° |
| C17 | C16 | C15 | 113.1° | 109.5° |
| C17 | C16 | C19 | 109.2° | 109.5° |
| C17 | C16 | C18 | 109.1° | 109.4° |
| C16 | C17 | H11 | 109.5° | 109.5° |
| C16 | C17 | H12 | 109.4° | 109.5° |
| C16 | C17 | H13 | 109.4° | 109.4° |
| C15 | C16 | C19 | 108.3° | 109.5° |
| C15 | C16 | C18 | 108.5° | 109.5° |
| C16 | C15 | H10 | 106.7° | 109.5° |
| C25 | C24 | H20 | 110.7° | 110.4° |
| C25 | C24 | H21 | 110.7° | 110.4° |
| C24 | C25 | H22 | 118.2° | 117.6° |
| C19 | C16 | C18 | 108.5° | 109.5° |
| C16 | C19 | H17 | 109.5° | 109.4° |
| C16 | C19 | H18 | 109.5° | 109.5° |
| C16 | C19 | H19 | 109.5° | 109.5° |
| C16 | C18 | H14 | 109.5° | 109.4° |
| C16 | C18 | H15 | 109.5° | 109.5° |
| C16 | C18 | H16 | 109.5° | 109.5° |
| H2 | C3 | H3 | 109.5° | 109.5° |
| H5 | C5 | H6 | 109.5° | 110.8° |
| H7 | C6 | H8 | 109.5° | 110.3° |
| H11 | C17 | H12 | 109.5° | 109.5° |
| H11 | C17 | H13 | 109.5° | 109.5° |
| H12 | C17 | H13 | 109.5° | 109.5° |
| H14 | C18 | H15 | 109.5° | 109.4° |
| H14 | C18 | H16 | 109.5° | 109.5° |
| H15 | C18 | H16 | 109.5° | 109.5° |
| H17 | C19 | H18 | 109.5° | 109.5° |
| H17 | C19 | H19 | 109.5° | 109.4° |
| H18 | C19 | H19 | 109.5° | 109.5° |
| H20 | C24 | H21 | 109.4° | 110.4° |
| H23 | C27 | H24 | 109.5° | 109.5° |
| H23 | C27 | H25 | 109.5° | 109.4° |
| H24 | C27 | H25 | 109.5° | 109.5° |
| H26 | C28 | H27 | 109.5° | 109.5° |
| H26 | C28 | H28 | 109.4° | 109.5° |
| H27 | C28 | H28 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O9 | C8 | N7 | C4 | 179.0° | 179.9° |
| O9 | C8 | N7 | C6 | 169.6° | 179.6° |
| O9 | C8 | C4 | C3 | 44.6° | 45.1° |
| O9 | C8 | C4 | C5 | 171.7° | 163.8° |
| O9 | C8 | C4 | H4 | 73.6° | 77.4° |
| O9 | C8 | N7 | H32 | 10.5° | 0.5° |
| C8 | N7 | C6 | H32 | 180.0° | 179.9° |
| N7 | C8 | C4 | C3 | 134.5° | 135.0° |
| N7 | C8 | C4 | C5 | 7.3° | 16.3° |
| C8 | N7 | C6 | C5 | 24.9° | 17.0° |
| N7 | C8 | C4 | H4 | 107.3° | 102.5° |
| C8 | N7 | C6 | H7 | 93.9° | 136.0° |
| C8 | N7 | C6 | H8 | 143.8° | 102.0° |
| C4 | C8 | N7 | C6 | 11.4° | 0.3° |
| C8 | C4 | C3 | C5 | 118.7° | 114.8° |
| C8 | C4 | C3 | H4 | 118.2° | 122.7° |
| C8 | C4 | C3 | C2 | 179.7° | 180.0° |
| C8 | C4 | C5 | H4 | 114.8° | 118.9° |
| C8 | C4 | C5 | C6 | 21.6° | 24.8° |
| C8 | C4 | C3 | H2 | 59.7° | 60.0° |
| C8 | C4 | C3 | H3 | 59.0° | 60.0° |
| C8 | C4 | C5 | H5 | 97.5° | 93.3° |
| C8 | C4 | C5 | H6 | 140.8° | 143.0° |
| C4 | C8 | N7 | H32 | 168.6° | 179.6° |
| N7 | C6 | C5 | C4 | 27.4° | 25.4° |
| N7 | C6 | C5 | H7 | 118.8° | 119.0° |
| N7 | C6 | C5 | H8 | 118.8° | 119.0° |
| N7 | C6 | C5 | H5 | 91.8° | 92.8° |
| N7 | C6 | C5 | H6 | 146.6° | 143.5° |
| N7 | C6 | H7 | H8 | 123.4° | 122.0° |
| F34 | C32 | F33 | F35 | 116.6° | 120.0° |
| F34 | C32 | F33 | C21 | 119.4° | 120.0° |
| F34 | C32 | F35 | C21 | 121.7° | 120.0° |
| F34 | C32 | C21 | N20 | 53.0° | 60.0° |
| F34 | C32 | C21 | O22 | 126.0° | 120.0° |
| C4 | C3 | C2 | H2 | 120.7° | 120.0° |
| C4 | C3 | C2 | H3 | 120.7° | 120.0° |
| C3 | C4 | C5 | H4 | 123.2° | 122.5° |
| C4 | C3 | C2 | C1 | 157.1° | 175.1° |
| C4 | C3 | C2 | N10 | 77.9° | 64.9° |
| C3 | C4 | C5 | C6 | 143.6° | 143.5° |
| C4 | C3 | C2 | H1 | 40.3° | 55.1° |
| C4 | C3 | H2 | H3 | 118.0° | 120.0° |
| C3 | C4 | C5 | H5 | 24.5° | 25.3° |
| C3 | C4 | C5 | H6 | 97.2° | 98.3° |
| C2 | C3 | C4 | C5 | 61.6° | 65.2° |
| C3 | C2 | C1 | N31 | 68.7° | 35.7° |
| C3 | C2 | C1 | N10 | 127.5° | 120.0° |
| C3 | C2 | C1 | H1 | 116.4° | 120.0° |
| C3 | C2 | N10 | H1 | 117.7° | 120.0° |
| C3 | C2 | N10 | C11 | 111.7° | 152.7° |
| C2 | C3 | H2 | H3 | 117.9° | 120.0° |
| C2 | C3 | C4 | H4 | 61.5° | 57.4° |
| C3 | C2 | N10 | H30 | 68.3° | 27.3° |
| C4 | C5 | C6 | H5 | 119.2° | 118.2° |
| C4 | C5 | C6 | H6 | 119.2° | 118.1° |
| C5 | C4 | C3 | H2 | 59.0° | 174.8° |
| C5 | C4 | C3 | H3 | 177.7° | 54.8° |
| C4 | C5 | H5 | H6 | 122.3° | 123.8° |
| C4 | C5 | C6 | H7 | 91.4° | 144.4° |
| C4 | C5 | C6 | H8 | 146.2° | 93.6° |
| N31 | C1 | C2 | N10 | 163.8° | 155.7° |
| N31 | C1 | C2 | H1 | 47.7° | 84.4° |
| C1 | C2 | N10 | H1 | 116.2° | 119.9° |
| C1 | C2 | N10 | C11 | 122.2° | 87.3° |
| C1 | C2 | C3 | H2 | 36.5° | 64.9° |
| C1 | C2 | C3 | H3 | 82.2° | 55.1° |
| C1 | C2 | N10 | H30 | 57.8° | 92.7° |
| C2 | N10 | C11 | H30 | 180.0° | 180.0° |
| C2 | N10 | C11 | C12 | 164.9° | 180.0° |
| C2 | N10 | C11 | O30 | 12.5° | 0.0° |
| N10 | C2 | C3 | H2 | 161.5° | 55.1° |
| N10 | C2 | C3 | H3 | 42.8° | 175.1° |
| N10 | C11 | C12 | O30 | 177.5° | 180.0° |
| N10 | C11 | C12 | C29 | 102.3° | 80.0° |
| N10 | C11 | C12 | N13 | 144.0° | 164.8° |
| C11 | N10 | C2 | H1 | 6.0° | 32.7° |
| N10 | C11 | C12 | H9 | 20.1° | 42.4° |
| F33 | C32 | F35 | C21 | 121.8° | 120.0° |
| F33 | C32 | C21 | N20 | 65.3° | 180.0° |
| F33 | C32 | C21 | O22 | 115.8° | 0.0° |
| F35 | C32 | C21 | N20 | 173.7° | 60.0° |
| F35 | C32 | C21 | O22 | 5.3° | 120.0° |
| C32 | C21 | N20 | O22 | 178.9° | 180.0° |
| C32 | C21 | N20 | C15 | 171.9° | 180.0° |
| C32 | C21 | N20 | H31 | 8.1° | 0.0° |
| C6 | C5 | C4 | H4 | 93.1° | 94.0° |
| C6 | C5 | H5 | H6 | 122.4° | 123.8° |
| C5 | C6 | H7 | H8 | 123.4° | 121.9° |
| C5 | C6 | N7 | H32 | 155.0° | 163.0° |
| O23 | C14 | N13 | C12 | 3.0° | 4.0° |
| O23 | C14 | C15 | N20 | 65.6° | 25.9° |
| O23 | C14 | N13 | C15 | 179.7° | 179.9° |
| O23 | C14 | N13 | C24 | 178.0° | 176.0° |
| O23 | C14 | C15 | C16 | 60.1° | 94.2° |
| O23 | C14 | C15 | H10 | 178.0° | 145.9° |
| C28 | C26 | C29 | C12 | 16.0° | 16.0° |
| C28 | C26 | C29 | C27 | 143.3° | 144.8° |
| C28 | C26 | C29 | C25 | 110.8° | 107.6° |
| C28 | C26 | C27 | C25 | 146.3° | 145.2° |
| C28 | C26 | C25 | C24 | 14.6° | 16.2° |
| C28 | C26 | C25 | H22 | 141.1° | 138.9° |
| C28 | C26 | C27 | H23 | 180.0° | 85.5° |
| C28 | C26 | C27 | H24 | 60.0° | 34.5° |
| C28 | C26 | C27 | H25 | 60.0° | 154.6° |
| C26 | C28 | H26 | H27 | 120.0° | 120.1° |
| C26 | C28 | H26 | H28 | 120.0° | 120.0° |
| C26 | C28 | H27 | H28 | 120.0° | 120.0° |
| C28 | C26 | C29 | H29 | 141.0° | 139.1° |
| C11 | C12 | C29 | N13 | 116.9° | 118.8° |
| C11 | C12 | C29 | H9 | 122.4° | 122.4° |
| C11 | C12 | N13 | H9 | 123.4° | 122.4° |
| C11 | C12 | N13 | C14 | 64.3° | 100.8° |
| C11 | C12 | C29 | C26 | 178.4° | 158.2° |
| C11 | C12 | C29 | C25 | 113.5° | 94.9° |
| C11 | C12 | N13 | C24 | 111.4° | 79.2° |
| C11 | C12 | C29 | H29 | 24.5° | 46.2° |
| C12 | C11 | N10 | H30 | 15.1° | 0.0° |
| C29 | C12 | N13 | H9 | 120.2° | 118.8° |
| C29 | C12 | C11 | O30 | 80.2° | 99.9° |
| C29 | C12 | N13 | C14 | 179.3° | 140.4° |
| C12 | C29 | C26 | C25 | 94.8° | 91.5° |
| C12 | C29 | C26 | H29 | 157.0° | 155.1° |
| C12 | C29 | C26 | C27 | 159.3° | 160.8° |
| C12 | C29 | C25 | H29 | 137.9° | 138.3° |
| C29 | C12 | N13 | C24 | 5.1° | 39.6° |
| C12 | C29 | C25 | C24 | 0.8° | 0.1° |
| C12 | C29 | C25 | H22 | 137.8° | 138.3° |
| N13 | C12 | C11 | O30 | 33.4° | 15.3° |
| C12 | N13 | C14 | C24 | 174.9° | 180.0° |
| C12 | N13 | C14 | C15 | 177.2° | 175.9° |
| N13 | C12 | C29 | C26 | 61.5° | 39.4° |
| N13 | C12 | C29 | C25 | 3.4° | 23.9° |
| C12 | N13 | C24 | C25 | 4.6° | 39.6° |
| C12 | N13 | C24 | H20 | 123.8° | 80.0° |
| C12 | N13 | C24 | H21 | 114.6° | 157.6° |
| N13 | C12 | C29 | H29 | 141.4° | 165.0° |
| O30 | C11 | C12 | H9 | 157.3° | 137.7° |
| O30 | C11 | N10 | H30 | 167.5° | 180.0° |
| C21 | N20 | C15 | H31 | 180.0° | 180.0° |
| C21 | N20 | C15 | C14 | 104.8° | 155.0° |
| C21 | N20 | C15 | C16 | 127.9° | 85.0° |
| C21 | N20 | C15 | H10 | 11.0° | 35.0° |
| N20 | C15 | C14 | N13 | 114.1° | 154.2° |
| N20 | C15 | C14 | C16 | 125.7° | 120.0° |
| N20 | C15 | C14 | H10 | 116.4° | 120.0° |
| C15 | N20 | C21 | O22 | 6.9° | 0.0° |
| N20 | C15 | C16 | C17 | 59.5° | 54.3° |
| N20 | C15 | C16 | H10 | 117.6° | 120.0° |
| N20 | C15 | C16 | C19 | 61.8° | 174.3° |
| N20 | C15 | C16 | C18 | 179.3° | 65.7° |
| N13 | C14 | C15 | C16 | 120.2° | 85.8° |
| C14 | N13 | C24 | C25 | 179.8° | 140.4° |
| C14 | N13 | C12 | H9 | 59.1° | 21.6° |
| N13 | C14 | C15 | H10 | 2.3° | 34.2° |
| C14 | N13 | C24 | H20 | 61.0° | 100.0° |
| C14 | N13 | C24 | H21 | 60.5° | 22.4° |
| C15 | C14 | N13 | C24 | 2.3° | 4.1° |
| C14 | C15 | C16 | C17 | 64.8° | 174.3° |
| C14 | C15 | C16 | H10 | 118.1° | 119.9° |
| C14 | C15 | C16 | C19 | 173.9° | 65.7° |
| C14 | C15 | C16 | C18 | 56.4° | 54.4° |
| C14 | C15 | N20 | H31 | 75.2° | 25.0° |
| O22 | C21 | N20 | H31 | 173.0° | 180.0° |
| C29 | C26 | C27 | C25 | 67.2° | 69.3° |
| C26 | C29 | C25 | H29 | 108.1° | 107.5° |
| C29 | C26 | C25 | C24 | 96.3° | 91.5° |
| C26 | C29 | C12 | H9 | 59.2° | 79.4° |
| C29 | C26 | C25 | H22 | 108.1° | 113.3° |
| C29 | C26 | C27 | H23 | 33.5° | 60.0° |
| C29 | C26 | C27 | H24 | 86.5° | 180.0° |
| C29 | C26 | C27 | H25 | 153.5° | 59.9° |
| C29 | C26 | C28 | H26 | 180.0° | 60.0° |
| C29 | C26 | C28 | H27 | 60.0° | 180.0° |
| C29 | C26 | C28 | H28 | 60.0° | 60.0° |
| C27 | C26 | C25 | C24 | 157.8° | 160.8° |
| C27 | C26 | C25 | H22 | 2.1° | 5.6° |
| C26 | C27 | H23 | H24 | 120.0° | 120.0° |
| C26 | C27 | H23 | H25 | 120.0° | 119.9° |
| C26 | C27 | H24 | H25 | 120.0° | 120.0° |
| C27 | C26 | C28 | H26 | 35.9° | 154.6° |
| C27 | C26 | C28 | H27 | 84.1° | 34.5° |
| C27 | C26 | C28 | H28 | 155.9° | 85.5° |
| C27 | C26 | C29 | H29 | 2.3° | 5.7° |
| C26 | C25 | C24 | N13 | 63.6° | 39.4° |
| C26 | C25 | C24 | H22 | 155.7° | 155.6° |
| C26 | C25 | C24 | H20 | 55.6° | 160.2° |
| C26 | C25 | C24 | H21 | 177.2° | 77.5° |
| C25 | C26 | C27 | H23 | 33.7° | 129.3° |
| C25 | C26 | C27 | H24 | 153.7° | 110.7° |
| C25 | C26 | C27 | H25 | 86.3° | 9.4° |
| C25 | C26 | C28 | H26 | 108.1° | 9.3° |
| C25 | C26 | C28 | H27 | 131.9° | 110.8° |
| C25 | C26 | C28 | H28 | 11.9° | 129.3° |
| C29 | C25 | C24 | N13 | 2.2° | 23.8° |
| C29 | C25 | C24 | H22 | 138.5° | 141.1° |
| C25 | C29 | C12 | H9 | 124.1° | 142.7° |
| C29 | C25 | C24 | H20 | 121.4° | 96.9° |
| C29 | C25 | C24 | H21 | 117.1° | 140.8° |
| N13 | C24 | C25 | H20 | 119.2° | 120.8° |
| N13 | C24 | C25 | H21 | 119.2° | 117.0° |
| C24 | N13 | C12 | H9 | 125.3° | 158.4° |
| N13 | C24 | H20 | H21 | 122.2° | 121.5° |
| N13 | C24 | C25 | H22 | 140.7° | 165.0° |
| C17 | C16 | C15 | C19 | 121.2° | 120.0° |
| C17 | C16 | C15 | C18 | 121.2° | 120.0° |
| C17 | C16 | C19 | C18 | 118.9° | 120.0° |
| C17 | C16 | C15 | H10 | 177.1° | 65.8° |
| C16 | C17 | H11 | H12 | 120.0° | 120.0° |
| C16 | C17 | H11 | H13 | 120.0° | 119.9° |
| C16 | C17 | H12 | H13 | 120.0° | 119.9° |
| C17 | C16 | C18 | H14 | 180.0° | 180.0° |
| C17 | C16 | C18 | H15 | 60.0° | 60.0° |
| C17 | C16 | C18 | H16 | 60.0° | 60.0° |
| C17 | C16 | C19 | H17 | 180.0° | 56.0° |
| C17 | C16 | C19 | H18 | 60.0° | 64.0° |
| C17 | C16 | C19 | H19 | 60.0° | 176.0° |
| C15 | C16 | C19 | C18 | 117.5° | 120.0° |
| C15 | C16 | C17 | H11 | 180.0° | 59.9° |
| C15 | C16 | C17 | H12 | 60.0° | 180.0° |
| C15 | C16 | C17 | H13 | 60.0° | 60.0° |
| C15 | C16 | C18 | H14 | 56.3° | 60.1° |
| C15 | C16 | C18 | H15 | 176.4° | 180.0° |
| C15 | C16 | C18 | H16 | 63.7° | 59.9° |
| C15 | C16 | C19 | H17 | 56.4° | 64.0° |
| C15 | C16 | C19 | H18 | 63.6° | 176.0° |
| C15 | C16 | C19 | H19 | 176.4° | 56.0° |
| C16 | C15 | N20 | H31 | 52.1° | 95.0° |
| C25 | C24 | H20 | H21 | 122.3° | 122.3° |
| C24 | C25 | C29 | H29 | 138.6° | 138.4° |
| C19 | C16 | C15 | H10 | 55.8° | 54.3° |
| C19 | C16 | C17 | H11 | 59.3° | 180.0° |
| C19 | C16 | C17 | H12 | 60.7° | 60.0° |
| C19 | C16 | C17 | H13 | 179.3° | 60.0° |
| C19 | C16 | C18 | H14 | 61.1° | 60.0° |
| C19 | C16 | C18 | H15 | 58.9° | 59.9° |
| C19 | C16 | C18 | H16 | 178.9° | 180.0° |
| C16 | C19 | H17 | H18 | 120.0° | 120.0° |
| C16 | C19 | H17 | H19 | 120.0° | 119.9° |
| C16 | C19 | H18 | H19 | 120.0° | 120.0° |
| C18 | C16 | C15 | H10 | 61.7° | 174.3° |
| C18 | C16 | C17 | H11 | 59.2° | 60.0° |
| C18 | C16 | C17 | H12 | 179.2° | 60.0° |
| C18 | C16 | C17 | H13 | 60.8° | 180.0° |
| C16 | C18 | H14 | H15 | 120.0° | 120.0° |
| C16 | C18 | H14 | H16 | 120.0° | 120.0° |
| C16 | C18 | H15 | H16 | 120.0° | 120.0° |
| C18 | C16 | C19 | H17 | 61.1° | 176.0° |
| C18 | C16 | C19 | H18 | 178.9° | 56.0° |
| C18 | C16 | C19 | H19 | 58.9° | 64.1° |
| H1 | C2 | C3 | H2 | 80.4° | 175.1° |
| H1 | C2 | C3 | H3 | 160.9° | 64.9° |
| H1 | C2 | N10 | H30 | 174.0° | 147.4° |
| H2 | C3 | C4 | H4 | 177.9° | 62.7° |
| H3 | C3 | C4 | H4 | 59.2° | 177.3° |
| H4 | C4 | C5 | H5 | 147.7° | 147.8° |
| H4 | C4 | C5 | H6 | 26.1° | 24.1° |
| H5 | C5 | C6 | H7 | 149.4° | 26.2° |
| H5 | C5 | C6 | H8 | 27.1° | 148.2° |
| H6 | C5 | C6 | H7 | 27.8° | 97.5° |
| H6 | C5 | C6 | H8 | 94.6° | 24.5° |
| H7 | C6 | N7 | H32 | 86.2° | 44.0° |
| H8 | C6 | N7 | H32 | 36.2° | 78.0° |
| H9 | C12 | C29 | H29 | 97.9° | 76.2° |
| H10 | C15 | N20 | H31 | 169.0° | 145.0° |
| H11 | C17 | H12 | H13 | 120.1° | 120.1° |
| H14 | C18 | H15 | H16 | 120.0° | 120.0° |
| H17 | C19 | H18 | H19 | 120.0° | 120.0° |
| H20 | C24 | C25 | H22 | 100.1° | 44.2° |
| H21 | C24 | C25 | H22 | 21.5° | 78.1° |
| H22 | C25 | C29 | H29 | 0.1° | 0.0° |
| H23 | C27 | H24 | H25 | 120.0° | 120.0° |
| H26 | C28 | H27 | H28 | 120.0° | 120.0° |
