Y7G
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C27 | C28 | sing | 1.56Å | 1.52Å | |
| C27 | C26 | sing | 1.55Å | 1.47Å | |
| C28 | C30 | sing | 1.56Å | 1.53Å | |
| C28 | C29 | sing | 1.59Å | 1.54Å | |
| O18 | C14 | doub | 1.21Å | 1.22Å | |
| C26 | C25 | sing | 1.56Å | 1.53Å | |
| C30 | C24 | sing | 1.55Å | 1.53Å | |
| C14 | N15 | sing | 1.34Å | 1.38Å | |
| C14 | C13 | sing | 1.51Å | 1.53Å | |
| C29 | C25 | sing | 1.57Å | 1.55Å | |
| N15 | C16 | sing | 1.47Å | 1.47Å | |
| C23 | C24 | sing | 1.53Å | 1.58Å | |
| C23 | O22 | sing | 1.45Å | 1.33Å | |
| C25 | C24 | sing | 1.56Å | 1.52Å | |
| O01 | C02 | doub | 1.22Å | 1.23Å | |
| C13 | C12 | sing | 1.53Å | 1.52Å | |
| C13 | C17 | sing | 1.55Å | 1.54Å | |
| O22 | C02 | sing | 1.35Å | 1.37Å | |
| C02 | N03 | sing | 1.35Å | 1.36Å | |
| C16 | C17 | sing | 1.54Å | 1.51Å | |
| C12 | C11 | sing | 1.53Å | 1.58Å | |
| C07 | C06 | sing | 1.53Å | 1.51Å | |
| N03 | C04 | sing | 1.46Å | 1.47Å | |
| N10 | C11 | sing | 1.46Å | 1.48Å | |
| N10 | C09 | sing | 1.35Å | 1.38Å | |
| C04 | C09 | sing | 1.51Å | 1.53Å | |
| C04 | C05 | sing | 1.53Å | 1.51Å | |
| C11 | C19 | sing | 1.53Å | 1.54Å | |
| C06 | C05 | sing | 1.53Å | 1.51Å | |
| C06 | C08 | sing | 1.53Å | 1.55Å | |
| C09 | O21 | doub | 1.21Å | 1.23Å | |
| C19 | O20 | sing | 1.43Å | 1.43Å | |
| C04 | H1 | sing | 1.09Å | 1.10Å | |
| C05 | H2 | sing | 1.09Å | 1.10Å | |
| C05 | H3 | sing | 1.09Å | 1.10Å | |
| C06 | H4 | sing | 1.09Å | 1.10Å | |
| C07 | H5 | sing | 1.09Å | 1.10Å | |
| C07 | H6 | sing | 1.09Å | 1.10Å | |
| C07 | H7 | sing | 1.09Å | 1.10Å | |
| C08 | H8 | sing | 1.09Å | 1.10Å | |
| C08 | H9 | sing | 1.09Å | 1.10Å | |
| C08 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | S1 | sing | 1.81Å | 1.07Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C24 | H23 | sing | 1.09Å | 1.10Å | |
| C25 | H24 | sing | 1.09Å | 1.10Å | |
| C26 | H25 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | H30 | sing | 1.09Å | 1.10Å | |
| C29 | H31 | sing | 1.09Å | 1.10Å | |
| C30 | H32 | sing | 1.09Å | 1.10Å | |
| C30 | H33 | sing | 1.09Å | 1.10Å | |
| N03 | H34 | sing | 0.97Å | 1.00Å | |
| N10 | H35 | sing | 0.97Å | 1.00Å | |
| N15 | H36 | sing | 0.97Å | 1.00Å | |
| O20 | H37 | sing | 0.97Å | 0.95Å | |
| S1 | O1 | doub | 1.42Å | 34.16Å | |
| S1 | O2 | doub | 1.42Å | 34.16Å | |
| S1 | O3 | sing | 1.52Å | 34.16Å | |
| O3 | H20 | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C28 | C27 | C26 | 105.0° | 104.6° |
| C27 | C28 | C30 | 107.3° | 105.3° |
| C27 | C28 | C29 | 103.6° | 101.1° |
| C28 | C27 | H27 | 110.6° | 110.4° |
| C28 | C27 | H28 | 110.6° | 110.3° |
| C27 | C28 | H29 | 115.2° | 115.9° |
| C27 | C26 | C25 | 103.9° | 104.6° |
| C27 | C26 | H25 | 110.8° | 110.4° |
| C27 | C26 | H26 | 110.8° | 110.5° |
| C26 | C27 | H27 | 110.6° | 110.2° |
| C26 | C27 | H28 | 110.6° | 110.6° |
| C30 | C28 | C29 | 98.9° | 99.8° |
| C28 | C30 | C24 | 101.7° | 104.5° |
| C30 | C28 | H29 | 115.1° | 115.6° |
| C28 | C30 | H32 | 111.4° | 110.4° |
| C28 | C30 | H33 | 111.4° | 110.4° |
| C28 | C29 | C25 | 93.5° | 95.4° |
| C29 | C28 | H29 | 115.0° | 116.9° |
| C28 | C29 | H30 | 113.3° | 112.0° |
| C28 | C29 | H31 | 113.3° | 112.0° |
| O18 | C14 | N15 | 127.0° | 125.0° |
| O18 | C14 | C13 | 123.0° | 124.9° |
| C26 | C25 | C29 | 100.4° | 101.4° |
| C26 | C25 | C24 | 109.4° | 104.5° |
| C26 | C25 | H24 | 115.3° | 115.9° |
| C25 | C26 | H25 | 110.8° | 110.4° |
| C25 | C26 | H26 | 110.8° | 110.4° |
| C30 | C24 | C23 | 108.6° | 110.4° |
| C30 | C24 | C25 | 105.5° | 104.7° |
| C30 | C24 | H23 | 108.8° | 110.4° |
| C24 | C30 | H32 | 111.4° | 111.4° |
| C24 | C30 | H33 | 111.4° | 109.5° |
| N15 | C14 | C13 | 110.0° | 110.1° |
| C14 | N15 | C16 | 112.3° | 111.3° |
| C14 | N15 | H36 | 123.9° | 124.3° |
| C14 | C13 | C12 | 114.4° | 110.5° |
| C14 | C13 | C17 | 102.6° | 104.2° |
| C14 | C13 | H14 | 108.6° | 110.6° |
| C29 | C25 | C24 | 99.2° | 100.7° |
| C29 | C25 | H24 | 115.0° | 116.2° |
| C25 | C29 | H30 | 113.3° | 111.9° |
| C25 | C29 | H31 | 113.3° | 112.9° |
| N15 | C16 | C17 | 104.4° | 105.4° |
| N15 | C16 | H15 | 110.8° | 110.3° |
| N15 | C16 | H16 | 110.7° | 110.3° |
| C16 | N15 | H36 | 123.8° | 124.3° |
| C24 | C23 | O22 | 98.1° | 109.4° |
| C23 | C24 | C25 | 116.6° | 110.4° |
| C24 | C23 | H21 | 112.2° | 109.5° |
| C24 | C23 | H22 | 112.3° | 109.4° |
| C23 | C24 | H23 | 108.2° | 110.4° |
| C23 | O22 | C02 | 118.8° | 117.0° |
| O22 | C23 | H21 | 112.2° | 109.5° |
| O22 | C23 | H22 | 112.2° | 109.4° |
| C25 | C24 | H23 | 108.9° | 110.4° |
| C24 | C25 | H24 | 115.5° | 115.9° |
| O01 | C02 | O22 | 116.9° | 120.0° |
| O01 | C02 | N03 | 127.4° | 119.9° |
| C12 | C13 | C17 | 113.9° | 110.5° |
| C13 | C12 | C11 | 112.6° | 109.5° |
| C13 | C12 | H12 | 108.7° | 109.5° |
| C13 | C12 | H13 | 108.7° | 109.5° |
| C12 | C13 | H14 | 108.6° | 110.4° |
| C13 | C17 | C16 | 107.7° | 101.8° |
| C17 | C13 | H14 | 108.4° | 110.5° |
| C13 | C17 | H17 | 109.9° | 111.0° |
| C13 | C17 | H18 | 109.9° | 111.0° |
| O22 | C02 | N03 | 115.7° | 120.0° |
| C02 | N03 | C04 | 120.9° | 120.0° |
| C02 | N03 | H34 | 119.6° | 120.0° |
| C17 | C16 | H15 | 110.7° | 110.3° |
| C17 | C16 | H16 | 110.7° | 110.2° |
| C16 | C17 | H17 | 109.9° | 111.0° |
| C16 | C17 | H18 | 109.9° | 111.0° |
| C12 | C11 | N10 | 109.9° | 109.4° |
| C12 | C11 | C19 | 109.8° | 109.5° |
| C12 | C11 | H11 | 107.9° | 109.5° |
| C11 | C12 | H12 | 108.7° | 109.5° |
| C11 | C12 | H13 | 108.7° | 109.4° |
| C07 | C06 | C05 | 111.5° | 109.5° |
| C07 | C06 | C08 | 110.8° | 109.4° |
| C07 | C06 | H4 | 108.3° | 109.5° |
| C06 | C07 | H5 | 109.5° | 109.5° |
| C06 | C07 | H6 | 109.4° | 109.5° |
| C06 | C07 | H7 | 109.5° | 109.4° |
| N03 | C04 | C09 | 110.2° | 109.5° |
| N03 | C04 | C05 | 110.9° | 109.5° |
| N03 | C04 | H1 | 108.5° | 109.5° |
| C04 | N03 | H34 | 119.5° | 120.0° |
| C11 | N10 | C09 | 123.2° | 120.0° |
| N10 | C11 | C19 | 111.8° | 109.5° |
| N10 | C11 | H11 | 109.1° | 109.5° |
| C11 | N10 | H35 | 118.4° | 120.0° |
| N10 | C09 | C04 | 123.2° | 120.0° |
| N10 | C09 | O21 | 118.3° | 120.0° |
| C09 | N10 | H35 | 118.4° | 120.0° |
| C09 | C04 | C05 | 111.2° | 109.4° |
| C04 | C09 | O21 | 118.5° | 120.0° |
| C09 | C04 | H1 | 107.8° | 109.5° |
| C04 | C05 | C06 | 115.0° | 109.5° |
| C05 | C04 | H1 | 108.1° | 109.4° |
| C04 | C05 | H2 | 108.1° | 109.5° |
| C04 | C05 | H3 | 108.1° | 109.5° |
| C11 | C19 | O20 | 108.0° | 109.5° |
| C19 | C11 | H11 | 108.3° | 109.5° |
| C11 | C19 | H19 | 106.4° | 109.5° |
| C11 | C19 | S1 | 110.2° | 109.5° |
| C05 | C06 | C08 | 110.1° | 109.4° |
| C06 | C05 | H2 | 108.1° | 109.4° |
| C06 | C05 | H3 | 108.1° | 109.5° |
| C05 | C06 | H4 | 108.3° | 109.5° |
| C08 | C06 | H4 | 107.8° | 109.5° |
| C06 | C08 | H8 | 109.5° | 109.5° |
| C06 | C08 | H9 | 109.5° | 109.5° |
| C06 | C08 | H10 | 109.4° | 109.5° |
| O20 | C19 | H19 | 107.8° | 109.5° |
| O20 | C19 | S1 | 110.1° | 109.5° |
| C19 | O20 | H37 | 109.5° | 114.0° |
| H2 | C05 | H3 | 109.5° | 109.4° |
| H5 | C07 | H6 | 109.5° | 109.5° |
| H5 | C07 | H7 | 109.5° | 109.5° |
| H6 | C07 | H7 | 109.5° | 109.4° |
| H8 | C08 | H9 | 109.4° | 109.4° |
| H8 | C08 | H10 | 109.5° | 109.4° |
| H9 | C08 | H10 | 109.5° | 109.5° |
| H12 | C12 | H13 | 109.5° | 109.4° |
| H15 | C16 | H16 | 109.5° | 110.2° |
| H17 | C17 | H18 | 109.5° | 110.8° |
| H19 | C19 | S1 | 114.1° | 109.4° |
| C19 | S1 | O1 | 140.3° | 110.5° |
| C19 | S1 | O2 | 140.3° | 110.5° |
| C19 | S1 | O3 | 140.3° | 104.4° |
| H21 | C23 | H22 | 109.5° | 109.5° |
| H25 | C26 | H26 | 109.5° | 110.4° |
| H27 | C27 | H28 | 109.4° | 110.5° |
| H30 | C29 | H31 | 109.5° | 111.7° |
| H32 | C30 | H33 | 109.4° | 110.4° |
| O1 | S1 | O2 | 0.0° | 121.0° |
| O1 | S1 | O3 | 0.0° | 104.3° |
| O2 | S1 | O3 | 0.0° | 104.3° |
| S1 | O3 | H20 | 90.0° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C28 | C27 | C26 | H27 | 119.3° | 118.7° |
| C28 | C27 | C26 | H28 | 119.3° | 118.8° |
| C27 | C28 | C30 | C29 | 107.4° | 104.4° |
| C27 | C28 | C30 | H29 | 129.6° | 129.3° |
| C27 | C28 | C29 | H29 | 126.6° | 126.8° |
| C28 | C27 | C26 | C25 | 9.4° | 0.1° |
| C27 | C28 | C30 | C24 | 66.4° | 69.2° |
| C27 | C28 | C29 | C25 | 49.8° | 53.0° |
| C28 | C27 | C26 | H25 | 109.7° | 118.8° |
| C28 | C27 | C26 | H26 | 128.5° | 118.8° |
| C28 | C27 | H27 | H28 | 122.1° | 122.3° |
| C27 | C28 | C29 | H30 | 167.1° | 63.2° |
| C27 | C28 | C29 | H31 | 67.5° | 170.3° |
| C27 | C28 | C30 | H32 | 52.4° | 170.9° |
| C27 | C28 | C30 | H33 | 174.9° | 48.5° |
| C26 | C27 | C28 | C30 | 77.5° | 70.0° |
| C26 | C27 | C28 | C29 | 26.5° | 33.5° |
| C27 | C26 | C25 | H25 | 119.1° | 118.7° |
| C27 | C26 | C25 | H26 | 119.1° | 118.9° |
| C27 | C26 | C25 | C29 | 41.6° | 34.1° |
| C27 | C26 | C25 | C24 | 62.0° | 70.3° |
| C27 | C26 | C25 | H24 | 165.8° | 160.9° |
| C27 | C26 | H25 | H26 | 122.6° | 122.5° |
| C26 | C27 | H27 | H28 | 122.1° | 122.5° |
| C26 | C27 | C28 | H29 | 152.9° | 160.8° |
| C30 | C28 | C29 | H29 | 123.1° | 125.4° |
| C28 | C30 | C24 | H32 | 118.8° | 119.2° |
| C28 | C30 | C24 | H33 | 118.8° | 118.3° |
| C30 | C28 | C29 | C25 | 60.5° | 54.9° |
| C28 | C30 | C24 | C23 | 121.0° | 117.5° |
| C28 | C30 | C24 | C25 | 4.8° | 1.3° |
| C28 | C30 | C24 | H23 | 121.5° | 120.1° |
| C30 | C28 | C27 | H27 | 163.2° | 48.6° |
| C30 | C28 | C27 | H28 | 41.8° | 171.0° |
| C30 | C28 | C29 | H30 | 56.8° | 171.0° |
| C30 | C28 | C29 | H31 | 177.8° | 62.5° |
| C28 | C30 | H32 | H33 | 123.6° | 122.4° |
| C28 | C29 | C25 | C26 | 54.9° | 53.1° |
| C29 | C28 | C30 | C24 | 41.0° | 35.3° |
| C28 | C29 | C25 | H30 | 117.3° | 116.3° |
| C28 | C29 | C25 | H31 | 117.3° | 116.7° |
| C28 | C29 | C25 | C24 | 56.8° | 54.3° |
| C28 | C29 | C25 | H24 | 179.3° | 179.7° |
| C29 | C28 | C27 | H27 | 92.8° | 152.1° |
| C29 | C28 | C27 | H28 | 145.8° | 85.5° |
| C28 | C29 | H30 | H31 | 127.5° | 126.6° |
| C29 | C28 | C30 | H32 | 159.8° | 84.6° |
| C29 | C28 | C30 | H33 | 77.7° | 153.0° |
| O18 | C14 | N15 | C13 | 179.7° | 179.9° |
| O18 | C14 | N15 | C16 | 179.6° | 179.6° |
| O18 | C14 | C13 | C12 | 46.1° | 45.1° |
| O18 | C14 | C13 | C17 | 170.0° | 163.8° |
| O18 | C14 | C13 | H14 | 75.4° | 77.5° |
| O18 | C14 | N15 | H36 | 0.4° | 0.5° |
| C26 | C25 | C24 | C30 | 71.6° | 71.1° |
| C26 | C25 | C29 | C24 | 111.8° | 107.4° |
| C26 | C25 | C29 | H24 | 124.4° | 126.6° |
| C26 | C25 | C24 | C23 | 49.1° | 47.7° |
| C26 | C25 | C24 | H24 | 132.0° | 128.8° |
| C26 | C25 | C24 | H23 | 171.8° | 170.0° |
| C25 | C26 | H25 | H26 | 122.6° | 122.3° |
| C25 | C26 | C27 | H27 | 128.7° | 118.7° |
| C25 | C26 | C27 | H28 | 109.9° | 118.9° |
| C26 | C25 | C29 | H30 | 172.2° | 63.2° |
| C26 | C25 | C29 | H31 | 62.3° | 169.8° |
| C30 | C24 | C25 | C29 | 32.9° | 33.8° |
| C30 | C24 | C23 | C25 | 118.9° | 115.3° |
| C30 | C24 | C23 | H23 | 117.9° | 122.4° |
| C30 | C24 | C23 | O22 | 92.7° | 70.8° |
| C30 | C24 | C25 | H23 | 116.6° | 118.8° |
| C30 | C24 | C23 | H21 | 149.2° | 169.2° |
| C30 | C24 | C23 | H22 | 25.4° | 49.2° |
| C30 | C24 | C25 | H24 | 156.4° | 160.0° |
| C24 | C30 | C28 | H29 | 164.0° | 161.5° |
| C24 | C30 | H32 | H33 | 123.6° | 121.9° |
| C14 | N15 | C16 | H36 | 180.0° | 179.9° |
| N15 | C14 | C13 | C12 | 134.2° | 134.9° |
| N15 | C14 | C13 | C17 | 10.3° | 16.3° |
| C14 | N15 | C16 | C17 | 10.6° | 17.0° |
| N15 | C14 | C13 | H14 | 104.3° | 102.5° |
| C14 | N15 | C16 | H15 | 108.6° | 136.0° |
| C14 | N15 | C16 | H16 | 129.8° | 102.0° |
| C13 | C14 | N15 | C16 | 0.1° | 0.4° |
| C14 | C13 | C12 | C17 | 117.6° | 114.7° |
| C14 | C13 | C12 | H14 | 121.5° | 122.7° |
| C14 | C13 | C17 | H14 | 114.7° | 118.8° |
| C14 | C13 | C17 | C16 | 16.6° | 24.8° |
| C14 | C13 | C12 | C11 | 179.7° | 179.3° |
| C14 | C13 | C12 | H12 | 59.2° | 59.2° |
| C14 | C13 | C12 | H13 | 59.9° | 60.7° |
| C14 | C13 | C17 | H17 | 103.2° | 93.4° |
| C14 | C13 | C17 | H18 | 136.3° | 142.9° |
| C13 | C14 | N15 | H36 | 179.9° | 179.6° |
| C29 | C25 | C24 | C23 | 153.6° | 152.6° |
| C29 | C25 | C24 | H24 | 123.5° | 126.3° |
| C29 | C25 | C24 | H23 | 83.7° | 85.1° |
| C29 | C25 | C26 | H25 | 77.4° | 152.8° |
| C29 | C25 | C26 | H26 | 160.7° | 84.9° |
| C25 | C29 | C28 | H29 | 176.4° | 179.7° |
| C25 | C29 | H30 | H31 | 127.5° | 127.7° |
| N15 | C16 | C17 | C13 | 16.9° | 25.4° |
| N15 | C16 | C17 | H15 | 119.2° | 119.1° |
| N15 | C16 | C17 | H16 | 119.2° | 119.0° |
| N15 | C16 | H15 | H16 | 122.4° | 122.0° |
| N15 | C16 | C17 | H17 | 102.9° | 92.8° |
| N15 | C16 | C17 | H18 | 136.6° | 143.5° |
| C24 | C23 | O22 | H21 | 118.1° | 120.0° |
| C24 | C23 | O22 | H22 | 118.1° | 119.9° |
| C23 | C24 | C25 | H23 | 122.7° | 122.4° |
| C24 | C23 | O22 | C02 | 177.8° | 180.0° |
| C24 | C23 | H21 | H22 | 125.4° | 120.0° |
| C23 | C24 | C25 | H24 | 82.9° | 81.2° |
| C23 | C24 | C30 | H32 | 2.2° | 123.2° |
| C23 | C24 | C30 | H33 | 120.3° | 0.8° |
| O22 | C23 | C24 | C25 | 148.3° | 174.0° |
| C23 | O22 | C02 | O01 | 3.9° | 0.3° |
| C23 | O22 | C02 | N03 | 176.0° | 179.9° |
| O22 | C23 | H21 | H22 | 125.3° | 120.0° |
| O22 | C23 | C24 | H23 | 25.2° | 51.6° |
| C25 | C24 | C23 | H21 | 30.3° | 53.9° |
| C25 | C24 | C23 | H22 | 93.6° | 66.1° |
| C24 | C25 | C26 | H25 | 178.9° | 48.5° |
| C24 | C25 | C26 | H26 | 57.1° | 170.8° |
| C24 | C25 | C29 | H30 | 60.4° | 170.6° |
| C24 | C25 | C29 | H31 | 174.1° | 62.4° |
| C25 | C24 | C30 | H32 | 123.6° | 118.0° |
| C25 | C24 | C30 | H33 | 114.0° | 119.6° |
| O01 | C02 | O22 | N03 | 179.9° | 179.7° |
| O01 | C02 | N03 | C04 | 5.1° | 0.1° |
| O01 | C02 | N03 | H34 | 174.8° | 180.0° |
| C12 | C13 | C17 | H14 | 121.0° | 122.5° |
| C12 | C13 | C17 | C16 | 140.8° | 143.5° |
| C13 | C12 | C11 | H12 | 120.5° | 120.0° |
| C13 | C12 | C11 | H13 | 120.5° | 120.0° |
| C13 | C12 | C11 | N10 | 63.3° | 63.3° |
| C13 | C12 | C11 | C19 | 173.3° | 176.7° |
| C13 | C12 | C11 | H11 | 55.6° | 56.7° |
| C13 | C12 | H12 | H13 | 118.6° | 120.0° |
| C12 | C13 | C17 | H17 | 21.1° | 25.3° |
| C12 | C13 | C17 | H18 | 99.4° | 98.4° |
| C13 | C17 | C16 | H17 | 119.7° | 118.2° |
| C13 | C17 | C16 | H18 | 119.7° | 118.1° |
| C17 | C13 | C12 | C11 | 62.0° | 66.0° |
| C17 | C13 | C12 | H12 | 58.4° | 173.9° |
| C17 | C13 | C12 | H13 | 177.5° | 54.0° |
| C13 | C17 | C16 | H15 | 102.3° | 144.5° |
| C13 | C17 | C16 | H16 | 136.0° | 93.6° |
| C13 | C17 | H17 | H18 | 120.8° | 123.8° |
| O22 | C02 | N03 | C04 | 174.7° | 179.7° |
| C02 | O22 | C23 | H21 | 64.1° | 60.0° |
| C02 | O22 | C23 | H22 | 59.7° | 60.1° |
| O22 | C02 | N03 | H34 | 5.3° | 0.3° |
| C02 | N03 | C04 | H34 | 180.0° | 180.0° |
| C02 | N03 | C04 | C09 | 56.1° | 155.0° |
| C02 | N03 | C04 | C05 | 179.8° | 85.0° |
| C02 | N03 | C04 | H1 | 61.7° | 35.0° |
| C16 | C17 | C13 | H14 | 98.2° | 94.0° |
| C17 | C16 | H15 | H16 | 122.4° | 121.9° |
| C16 | C17 | H17 | H18 | 120.8° | 123.8° |
| C17 | C16 | N15 | H36 | 169.4° | 163.0° |
| C12 | C11 | N10 | C19 | 122.2° | 120.0° |
| C12 | C11 | N10 | H11 | 118.1° | 120.0° |
| C12 | C11 | N10 | C09 | 129.7° | 158.0° |
| C12 | C11 | C19 | H11 | 117.5° | 120.0° |
| C12 | C11 | C19 | O20 | 60.3° | 55.0° |
| C11 | C12 | H12 | H13 | 118.6° | 120.0° |
| C11 | C12 | C13 | H14 | 58.9° | 56.6° |
| C12 | C11 | C19 | H19 | 175.8° | 175.1° |
| C12 | C11 | C19 | S1 | 60.0° | 65.0° |
| C12 | C11 | N10 | H35 | 50.2° | 22.0° |
| C07 | C06 | C05 | C04 | 64.8° | 175.0° |
| C07 | C06 | C05 | C08 | 123.4° | 119.9° |
| C07 | C06 | C05 | H4 | 119.0° | 120.1° |
| C07 | C06 | C08 | H4 | 118.3° | 120.0° |
| C07 | C06 | C05 | H2 | 174.3° | 55.0° |
| C07 | C06 | C05 | H3 | 56.0° | 64.9° |
| C06 | C07 | H5 | H6 | 120.0° | 120.0° |
| C06 | C07 | H5 | H7 | 120.0° | 120.0° |
| C06 | C07 | H6 | H7 | 120.0° | 119.9° |
| C07 | C06 | C08 | H8 | 180.0° | 180.0° |
| C07 | C06 | C08 | H9 | 60.0° | 60.1° |
| C07 | C06 | C08 | H10 | 60.0° | 60.0° |
| N03 | C04 | C09 | N10 | 121.4° | 180.0° |
| N03 | C04 | C09 | C05 | 123.5° | 120.0° |
| N03 | C04 | C09 | H1 | 118.2° | 120.1° |
| N03 | C04 | C05 | H1 | 118.8° | 120.0° |
| N03 | C04 | C05 | C06 | 70.0° | 65.0° |
| N03 | C04 | C09 | O21 | 59.1° | 0.0° |
| N03 | C04 | C05 | H2 | 50.8° | 55.0° |
| N03 | C04 | C05 | H3 | 169.1° | 175.0° |
| C11 | N10 | C09 | H35 | 180.0° | 180.0° |
| C11 | N10 | C09 | C04 | 179.4° | 180.0° |
| N10 | C11 | C19 | H11 | 120.2° | 120.1° |
| C11 | N10 | C09 | O21 | 1.1° | 0.0° |
| N10 | C11 | C19 | O20 | 177.5° | 175.0° |
| N10 | C11 | C12 | H12 | 176.3° | 56.7° |
| N10 | C11 | C12 | H13 | 57.2° | 176.7° |
| N10 | C11 | C19 | H19 | 62.0° | 65.0° |
| N10 | C11 | C19 | S1 | 62.2° | 55.0° |
| N10 | C09 | C04 | O21 | 179.5° | 180.0° |
| N10 | C09 | C04 | C05 | 115.1° | 60.0° |
| C09 | N10 | C11 | C19 | 108.1° | 82.0° |
| N10 | C09 | C04 | H1 | 3.2° | 59.9° |
| C09 | N10 | C11 | H11 | 11.7° | 38.0° |
| C09 | C04 | C05 | H1 | 118.2° | 120.0° |
| C09 | C04 | C05 | C06 | 166.9° | 175.0° |
| C09 | C04 | C05 | H2 | 72.3° | 65.0° |
| C09 | C04 | C05 | H3 | 46.1° | 55.0° |
| C09 | C04 | N03 | H34 | 123.9° | 25.0° |
| C04 | C09 | N10 | H35 | 0.6° | 0.0° |
| C04 | C05 | C06 | H2 | 120.8° | 120.0° |
| C04 | C05 | C06 | H3 | 120.8° | 120.1° |
| C04 | C05 | C06 | C08 | 171.8° | 65.0° |
| C05 | C04 | C09 | O21 | 64.4° | 120.0° |
| C04 | C05 | H2 | H3 | 117.5° | 120.0° |
| C04 | C05 | C06 | H4 | 54.1° | 54.9° |
| C05 | C04 | N03 | H34 | 0.3° | 95.0° |
| C11 | C19 | O20 | H19 | 114.6° | 120.0° |
| C11 | C19 | O20 | S1 | 120.3° | 120.0° |
| C19 | C11 | C12 | H12 | 52.9° | 63.3° |
| C19 | C11 | C12 | H13 | 66.2° | 56.7° |
| C11 | C19 | H19 | S1 | 121.7° | 120.0° |
| C19 | C11 | N10 | H35 | 71.9° | 98.0° |
| C11 | C19 | O20 | H37 | 180.0° | 60.0° |
| C11 | C19 | S1 | O1 | 73.2° | 63.4° |
| C11 | C19 | S1 | O2 | 73.2° | 73.3° |
| C11 | C19 | S1 | O3 | 73.2° | 175.0° |
| C05 | C06 | C08 | H4 | 117.9° | 120.0° |
| C06 | C05 | C04 | H1 | 48.7° | 55.1° |
| C06 | C05 | H2 | H3 | 117.5° | 120.0° |
| C05 | C06 | C07 | H5 | 180.0° | 59.9° |
| C05 | C06 | C07 | H6 | 60.0° | 180.0° |
| C05 | C06 | C07 | H7 | 60.0° | 60.1° |
| C05 | C06 | C08 | H8 | 56.2° | 60.0° |
| C05 | C06 | C08 | H9 | 63.8° | 180.0° |
| C05 | C06 | C08 | H10 | 176.2° | 59.9° |
| C08 | C06 | C05 | H2 | 51.0° | 175.0° |
| C08 | C06 | C05 | H3 | 67.4° | 55.0° |
| C08 | C06 | C07 | H5 | 57.0° | 60.0° |
| C08 | C06 | C07 | H6 | 63.0° | 60.0° |
| C08 | C06 | C07 | H7 | 177.0° | 180.0° |
| C06 | C08 | H8 | H9 | 120.0° | 120.0° |
| C06 | C08 | H8 | H10 | 120.0° | 120.0° |
| C06 | C08 | H9 | H10 | 120.0° | 120.1° |
| O21 | C09 | C04 | H1 | 177.3° | 120.1° |
| O21 | C09 | N10 | H35 | 178.9° | 180.0° |
| O20 | C19 | C11 | H11 | 57.3° | 65.0° |
| O20 | C19 | H19 | S1 | 122.7° | 120.0° |
| O20 | C19 | S1 | O1 | 45.7° | 56.6° |
| O20 | C19 | S1 | O2 | 45.7° | 166.6° |
| O20 | C19 | S1 | O3 | 45.7° | 55.0° |
| H1 | C04 | C05 | H2 | 169.5° | 175.0° |
| H1 | C04 | C05 | H3 | 72.1° | 65.0° |
| H1 | C04 | N03 | H34 | 118.3° | 145.0° |
| H2 | C05 | C06 | H4 | 66.7° | 65.0° |
| H3 | C05 | C06 | H4 | 175.0° | 175.0° |
| H4 | C06 | C07 | H5 | 61.0° | 180.0° |
| H4 | C06 | C07 | H6 | 179.0° | 60.0° |
| H4 | C06 | C07 | H7 | 59.0° | 60.0° |
| H4 | C06 | C08 | H8 | 61.7° | 60.0° |
| H4 | C06 | C08 | H9 | 178.3° | 60.0° |
| H4 | C06 | C08 | H10 | 58.3° | 179.9° |
| H5 | C07 | H6 | H7 | 120.0° | 120.0° |
| H8 | C08 | H9 | H10 | 120.0° | 119.9° |
| H11 | C11 | C12 | H12 | 64.9° | 176.7° |
| H11 | C11 | C12 | H13 | 176.0° | 63.3° |
| H11 | C11 | C19 | H19 | 58.3° | 55.1° |
| H11 | C11 | C19 | S1 | 177.6° | 175.0° |
| H11 | C11 | N10 | H35 | 168.3° | 141.9° |
| H12 | C12 | C13 | H14 | 179.4° | 63.5° |
| H13 | C12 | C13 | H14 | 61.6° | 176.5° |
| H14 | C13 | C17 | H17 | 142.1° | 147.8° |
| H14 | C13 | C17 | H18 | 21.6° | 24.1° |
| H15 | C16 | C17 | H17 | 137.9° | 26.3° |
| H15 | C16 | C17 | H18 | 17.4° | 97.4° |
| H15 | C16 | N15 | H36 | 71.4° | 43.9° |
| H16 | C16 | C17 | H17 | 16.3° | 148.2° |
| H16 | C16 | C17 | H18 | 104.2° | 24.5° |
| H16 | C16 | N15 | H36 | 50.2° | 78.0° |
| H19 | C19 | O20 | H37 | 65.4° | 180.0° |
| H19 | C19 | S1 | O1 | 167.1° | 176.7° |
| H19 | C19 | S1 | O2 | 167.1° | 46.6° |
| H19 | C19 | S1 | O3 | 167.1° | 65.0° |
| S1 | C19 | O20 | H37 | 59.7° | 60.0° |
| C19 | S1 | O1 | O2 | 90.0° | 131.5° |
| C19 | S1 | O1 | O3 | 90.0° | 111.7° |
| C19 | S1 | O2 | O3 | 90.0° | 111.8° |
| C19 | S1 | O3 | H20 | 90.0° | 180.0° |
| H21 | C23 | C24 | H23 | 92.8° | 68.5° |
| H22 | C23 | C24 | H23 | 143.3° | 171.5° |
| H23 | C24 | C25 | H24 | 39.8° | 41.2° |
| H23 | C24 | C30 | H32 | 119.7° | 0.8° |
| H23 | C24 | C30 | H33 | 2.8° | 121.6° |
| H24 | C25 | C26 | H25 | 46.7° | 80.4° |
| H24 | C25 | C26 | H26 | 75.1° | 42.0° |
| H24 | C25 | C29 | H30 | 63.4° | 63.4° |
| H24 | C25 | C29 | H31 | 62.1° | 63.6° |
| H25 | C26 | C27 | H27 | 9.6° | 0.1° |
| H25 | C26 | C27 | H28 | 131.0° | 122.4° |
| H26 | C26 | C27 | H27 | 112.2° | 122.5° |
| H26 | C26 | C27 | H28 | 9.2° | 0.0° |
| H27 | C27 | C28 | H29 | 33.6° | 80.6° |
| H28 | C27 | C28 | H29 | 87.8° | 41.8° |
| H29 | C28 | C29 | H30 | 66.3° | 63.5° |
| H29 | C28 | C29 | H31 | 59.1° | 62.9° |
| H29 | C28 | C30 | H32 | 77.2° | 41.6° |
| H29 | C28 | C30 | H33 | 45.3° | 80.8° |
| O1 | S1 | O2 | O3 | 90.0° | 116.8° |
| O1 | S1 | O3 | H20 | 90.0° | 63.9° |
| O2 | S1 | O3 | H20 | 90.0° | 63.9° |
