ET6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C26 | N27 | sing | 1.48Å | 1.51Å | |
| C26 | C25 | sing | 1.53Å | 1.56Å | |
| N27 | C32 | sing | 1.48Å | 1.51Å | |
| O18 | C14 | doub | 1.21Å | 1.23Å | |
| C25 | C32 | sing | 1.53Å | 1.56Å | |
| C25 | C33 | sing | 1.53Å | 1.55Å | |
| C25 | C24 | sing | 1.53Å | 1.55Å | |
| C33 | C23 | sing | 1.54Å | 1.57Å | |
| C14 | N15 | sing | 1.35Å | 1.39Å | |
| C14 | C13 | sing | 1.51Å | 1.52Å | |
| N15 | C16 | sing | 1.47Å | 1.47Å | |
| C23 | C24 | sing | 1.54Å | 1.58Å | |
| C23 | O22 | sing | 1.45Å | 1.42Å | |
| O01 | C02 | doub | 1.21Å | 1.24Å | |
| C13 | C12 | sing | 1.53Å | 1.55Å | |
| C13 | C17 | sing | 1.55Å | 1.55Å | |
| C02 | O22 | sing | 1.35Å | 1.39Å | |
| C02 | N03 | sing | 1.35Å | 1.38Å | |
| C16 | C17 | sing | 1.55Å | 1.55Å | |
| C12 | C11 | sing | 1.53Å | 1.56Å | |
| N03 | C04 | sing | 1.46Å | 1.48Å | |
| SG | C19 | sing | 1.81Å | 1.81Å | |
| C07 | C06 | sing | 1.53Å | 1.52Å | |
| N10 | C11 | sing | 1.46Å | 1.47Å | |
| N10 | C09 | sing | 1.35Å | 1.39Å | |
| C04 | C09 | sing | 1.51Å | 1.57Å | |
| C04 | C05 | sing | 1.53Å | 1.55Å | |
| C11 | C19 | sing | 1.53Å | 1.56Å | |
| C09 | O21 | doub | 1.21Å | 1.23Å | |
| C06 | C05 | sing | 1.53Å | 1.54Å | |
| C06 | C08 | sing | 1.53Å | 1.53Å | |
| C19 | O20 | sing | 1.43Å | 1.41Å | |
| C33 | H1 | sing | 1.09Å | 1.10Å | |
| C33 | H2 | sing | 1.09Å | 1.10Å | |
| C32 | H3 | sing | 1.09Å | 1.10Å | |
| C32 | H4 | sing | 1.09Å | 1.10Å | |
| N10 | H5 | sing | 0.97Å | 1.00Å | |
| C23 | H6 | sing | 1.09Å | 1.10Å | |
| C24 | H7 | sing | 1.09Å | 1.10Å | |
| C24 | H8 | sing | 1.09Å | 1.10Å | |
| C26 | H9 | sing | 1.09Å | 1.10Å | |
| C26 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C19 | H13 | sing | 1.09Å | 1.10Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C13 | H19 | sing | 1.09Å | 1.10Å | |
| C04 | H20 | sing | 1.09Å | 1.10Å | |
| C05 | H21 | sing | 1.09Å | 1.10Å | |
| C05 | H22 | sing | 1.09Å | 1.10Å | |
| C06 | H23 | sing | 1.09Å | 1.10Å | |
| C07 | H24 | sing | 1.09Å | 1.10Å | |
| C07 | H25 | sing | 1.09Å | 1.10Å | |
| C07 | H26 | sing | 1.09Å | 1.10Å | |
| C08 | H27 | sing | 1.09Å | 1.10Å | |
| C08 | H28 | sing | 1.09Å | 1.10Å | |
| C08 | H29 | sing | 1.09Å | 1.10Å | |
| N03 | H30 | sing | 0.97Å | 1.00Å | |
| N15 | H31 | sing | 0.97Å | 1.00Å | |
| O20 | H34 | sing | 0.97Å | 0.95Å | |
| SG | O2 | sing | 1.52Å | 33.66Å | |
| SG | O1 | doub | 1.42Å | 1.79Å | |
| SG | O3 | doub | 1.42Å | 33.66Å | |
| N27 | S1 | sing | 1.66Å | 38.56Å | |
| S1 | C1 | sing | 1.81Å | 0.00Å | |
| S1 | O5 | doub | 1.42Å | 0.00Å | |
| S1 | O4 | doub | 1.42Å | 0.00Å | |
| O2 | H32 | sing | 0.97Å | 0.00Å | |
| C1 | H33 | sing | 1.09Å | 0.00Å | |
| C1 | H35 | sing | 1.09Å | 0.00Å | |
| C1 | H36 | sing | 1.09Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N27 | C26 | C25 | 91.8° | 85.7° |
| C26 | N27 | C32 | 90.2° | 91.3° |
| N27 | C26 | H9 | 113.7° | 113.8° |
| N27 | C26 | H10 | 113.7° | 113.8° |
| C26 | N27 | S1 | 34.5° | 134.3° |
| C26 | C25 | C32 | 85.9° | 87.4° |
| C26 | C25 | C33 | 121.2° | 121.3° |
| C26 | C25 | C24 | 125.1° | 121.3° |
| C25 | C26 | H9 | 113.7° | 113.8° |
| C25 | C26 | H10 | 113.7° | 113.8° |
| N27 | C32 | C25 | 91.7° | 85.8° |
| N27 | C32 | H3 | 113.7° | 113.8° |
| N27 | C32 | H4 | 113.7° | 114.0° |
| C32 | N27 | S1 | 122.0° | 134.4° |
| O18 | C14 | N15 | 122.5° | 125.0° |
| O18 | C14 | C13 | 127.4° | 124.9° |
| C32 | C25 | C33 | 119.9° | 121.3° |
| C32 | C25 | C24 | 122.2° | 121.3° |
| C25 | C32 | H3 | 113.7° | 113.8° |
| C25 | C32 | H4 | 113.7° | 113.8° |
| C33 | C25 | C24 | 86.7° | 88.1° |
| C25 | C33 | C23 | 90.8° | 86.8° |
| C25 | C33 | H1 | 113.9° | 113.7° |
| C25 | C33 | H2 | 113.9° | 113.8° |
| C25 | C24 | C23 | 90.7° | 86.8° |
| C25 | C24 | H7 | 113.9° | 113.7° |
| C25 | C24 | H8 | 113.9° | 113.7° |
| C33 | C23 | C24 | 85.0° | 87.3° |
| C33 | C23 | O22 | 123.1° | 113.6° |
| C23 | C33 | H1 | 113.9° | 113.6° |
| C23 | C33 | H2 | 113.9° | 113.7° |
| C33 | C23 | H6 | 109.5° | 113.6° |
| N15 | C14 | C13 | 110.1° | 110.1° |
| C14 | N15 | C16 | 112.3° | 111.3° |
| C14 | N15 | H31 | 123.8° | 124.3° |
| C14 | C13 | C12 | 110.1° | 110.5° |
| C14 | C13 | C17 | 103.9° | 104.2° |
| C14 | C13 | H19 | 110.6° | 110.6° |
| N15 | C16 | C17 | 104.6° | 105.5° |
| N15 | C16 | H14 | 110.7° | 110.2° |
| N15 | C16 | H15 | 110.6° | 110.3° |
| C16 | N15 | H31 | 123.8° | 124.4° |
| C24 | C23 | O22 | 115.1° | 113.6° |
| C24 | C23 | H6 | 109.4° | 113.6° |
| C23 | C24 | H7 | 113.9° | 113.7° |
| C23 | C24 | H8 | 113.9° | 113.7° |
| C23 | O22 | C02 | 121.0° | 117.0° |
| O22 | C23 | H6 | 111.6° | 112.9° |
| O01 | C02 | O22 | 118.3° | 120.0° |
| O01 | C02 | N03 | 122.5° | 120.0° |
| C12 | C13 | C17 | 111.8° | 110.4° |
| C13 | C12 | C11 | 111.2° | 109.4° |
| C13 | C12 | H17 | 109.0° | 109.4° |
| C13 | C12 | H18 | 109.0° | 109.5° |
| C12 | C13 | H19 | 110.2° | 110.4° |
| C13 | C17 | C16 | 105.8° | 101.8° |
| C13 | C17 | H11 | 110.4° | 110.9° |
| C13 | C17 | H12 | 110.4° | 111.0° |
| C17 | C13 | H19 | 110.2° | 110.5° |
| O22 | C02 | N03 | 119.2° | 120.0° |
| C02 | N03 | C04 | 124.5° | 120.0° |
| C02 | N03 | H30 | 117.8° | 120.0° |
| C16 | C17 | H11 | 110.4° | 110.9° |
| C16 | C17 | H12 | 110.4° | 111.0° |
| C17 | C16 | H14 | 110.7° | 110.2° |
| C17 | C16 | H15 | 110.7° | 110.2° |
| C12 | C11 | N10 | 110.0° | 109.4° |
| C12 | C11 | C19 | 110.3° | 109.4° |
| C12 | C11 | H16 | 108.5° | 109.5° |
| C11 | C12 | H17 | 109.0° | 109.5° |
| C11 | C12 | H18 | 109.0° | 109.5° |
| N03 | C04 | C09 | 110.8° | 109.4° |
| N03 | C04 | C05 | 110.0° | 109.5° |
| N03 | C04 | H20 | 110.2° | 109.5° |
| C04 | N03 | H30 | 117.8° | 120.0° |
| SG | C19 | C11 | 110.1° | 109.5° |
| SG | C19 | O20 | 111.0° | 109.5° |
| SG | C19 | H13 | 107.1° | 109.5° |
| C19 | SG | O2 | 136.1° | 104.5° |
| C19 | SG | O1 | 103.1° | 110.5° |
| C19 | SG | O3 | 136.1° | 110.5° |
| C07 | C06 | C05 | 111.6° | 109.5° |
| C07 | C06 | C08 | 107.5° | 109.5° |
| C07 | C06 | H23 | 108.8° | 109.5° |
| C06 | C07 | H24 | 109.5° | 109.5° |
| C06 | C07 | H25 | 109.4° | 109.5° |
| C06 | C07 | H26 | 109.5° | 109.4° |
| C11 | N10 | C09 | 121.9° | 120.0° |
| N10 | C11 | C19 | 109.9° | 109.5° |
| C11 | N10 | H5 | 119.0° | 120.1° |
| N10 | C11 | H16 | 109.7° | 109.5° |
| N10 | C09 | C04 | 119.5° | 120.0° |
| N10 | C09 | O21 | 119.9° | 120.0° |
| C09 | N10 | H5 | 119.1° | 120.0° |
| C09 | C04 | C05 | 107.3° | 109.5° |
| C04 | C09 | O21 | 120.7° | 120.0° |
| C09 | C04 | H20 | 109.1° | 109.5° |
| C04 | C05 | C06 | 114.4° | 109.5° |
| C05 | C04 | H20 | 109.4° | 109.5° |
| C04 | C05 | H21 | 108.2° | 109.5° |
| C04 | C05 | H22 | 108.2° | 109.5° |
| C11 | C19 | O20 | 106.7° | 109.4° |
| C11 | C19 | H13 | 109.8° | 109.5° |
| C19 | C11 | H16 | 108.5° | 109.5° |
| C05 | C06 | C08 | 111.5° | 109.5° |
| C06 | C05 | H21 | 108.2° | 109.4° |
| C06 | C05 | H22 | 108.2° | 109.5° |
| C05 | C06 | H23 | 108.6° | 109.5° |
| C08 | C06 | H23 | 108.7° | 109.5° |
| C06 | C08 | H27 | 109.5° | 109.5° |
| C06 | C08 | H28 | 109.5° | 109.5° |
| C06 | C08 | H29 | 109.4° | 109.5° |
| O20 | C19 | H13 | 112.1° | 109.5° |
| C19 | O20 | H34 | 109.5° | 113.9° |
| H1 | C33 | H2 | 109.5° | 112.9° |
| H3 | C32 | H4 | 109.5° | 113.0° |
| H7 | C24 | H8 | 109.4° | 112.9° |
| H9 | C26 | H10 | 109.5° | 113.1° |
| H11 | C17 | H12 | 109.4° | 110.9° |
| H14 | C16 | H15 | 109.5° | 110.2° |
| H17 | C12 | H18 | 109.5° | 109.5° |
| H21 | C05 | H22 | 109.5° | 109.5° |
| H24 | C07 | H25 | 109.4° | 109.5° |
| H24 | C07 | H26 | 109.5° | 109.5° |
| H25 | C07 | H26 | 109.5° | 109.5° |
| H27 | C08 | H28 | 109.5° | 109.4° |
| H27 | C08 | H29 | 109.5° | 109.5° |
| H28 | C08 | H29 | 109.5° | 109.4° |
| O2 | SG | O1 | 83.1° | 104.2° |
| O2 | SG | O3 | 0.0° | 104.3° |
| SG | O2 | H32 | 90.0° | 114.0° |
| O1 | SG | O3 | 83.1° | 121.1° |
| N27 | S1 | C1 | 90.0° | 104.4° |
| N27 | S1 | O5 | 90.0° | 104.3° |
| N27 | S1 | O4 | 90.0° | 104.3° |
| C1 | S1 | O5 | 90.0° | 110.5° |
| C1 | S1 | O4 | 90.0° | 110.6° |
| S1 | C1 | H33 | 90.0° | 109.5° |
| S1 | C1 | H35 | 90.0° | 109.5° |
| S1 | C1 | H36 | 90.0° | 109.4° |
| O5 | S1 | O4 | 90.0° | 121.0° |
| H33 | C1 | H35 | 90.0° | 109.5° |
| H33 | C1 | H36 | 90.0° | 109.5° |
| H35 | C1 | H36 | 90.0° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N27 | C26 | C25 | H9 | 116.9° | 114.1° |
| N27 | C26 | C25 | H10 | 116.9° | 114.2° |
| C26 | N27 | C32 | S1 | 14.1° | 180.0° |
| N27 | C26 | C25 | C32 | 4.9° | 23.0° |
| N27 | C26 | C25 | C33 | 117.9° | 148.5° |
| N27 | C26 | C25 | C24 | 132.0° | 102.5° |
| C26 | N27 | C32 | H3 | 122.0° | 138.1° |
| C26 | N27 | C32 | H4 | 111.8° | 90.4° |
| N27 | C26 | H9 | H10 | 128.4° | 132.0° |
| C26 | N27 | S1 | C1 | 90.0° | 90.0° |
| C26 | N27 | S1 | O5 | 90.0° | 154.0° |
| C26 | N27 | S1 | O4 | 90.0° | 26.1° |
| C26 | C25 | C32 | C33 | 124.0° | 125.5° |
| C26 | C25 | C32 | C24 | 129.5° | 125.5° |
| C26 | C25 | C33 | C24 | 129.7° | 126.0° |
| C26 | C25 | C33 | C23 | 110.0° | 101.2° |
| C26 | C25 | C24 | C23 | 106.8° | 101.2° |
| C26 | C25 | C33 | H1 | 6.7° | 144.3° |
| C26 | C25 | C33 | H2 | 133.2° | 13.3° |
| C26 | C25 | C32 | H3 | 121.8° | 137.2° |
| C26 | C25 | C32 | H4 | 111.9° | 91.3° |
| C26 | C25 | C24 | H7 | 136.4° | 13.3° |
| C26 | C25 | C24 | H8 | 9.9° | 144.3° |
| C25 | C26 | H9 | H10 | 128.4° | 132.0° |
| C25 | C26 | N27 | S1 | 163.7° | 156.2° |
| N27 | C32 | C25 | H3 | 116.9° | 114.2° |
| N27 | C32 | C25 | H4 | 116.9° | 114.3° |
| N27 | C32 | C25 | C33 | 119.0° | 148.5° |
| N27 | C32 | C25 | C24 | 134.5° | 102.5° |
| N27 | C32 | H3 | H4 | 128.4° | 132.0° |
| C32 | N27 | C26 | H9 | 111.8° | 90.3° |
| C32 | N27 | C26 | H10 | 122.0° | 138.1° |
| C32 | N27 | S1 | C1 | 90.0° | 90.0° |
| C32 | N27 | S1 | O5 | 90.0° | 26.0° |
| C32 | N27 | S1 | O4 | 90.0° | 153.9° |
| O18 | C14 | N15 | C13 | 178.9° | 179.9° |
| O18 | C14 | N15 | C16 | 179.3° | 179.6° |
| O18 | C14 | C13 | C12 | 49.9° | 45.2° |
| O18 | C14 | C13 | C17 | 169.7° | 163.8° |
| O18 | C14 | C13 | H19 | 72.1° | 77.4° |
| O18 | C14 | N15 | H31 | 0.6° | 0.5° |
| C32 | C25 | C33 | C24 | 125.6° | 126.1° |
| C32 | C25 | C33 | C23 | 145.3° | 150.9° |
| C32 | C25 | C24 | C23 | 143.3° | 150.9° |
| C32 | C25 | C33 | H1 | 98.0° | 36.5° |
| C32 | C25 | C33 | H2 | 28.6° | 94.6° |
| C25 | C32 | H3 | H4 | 128.4° | 131.8° |
| C32 | C25 | C24 | H7 | 26.5° | 94.6° |
| C32 | C25 | C24 | H8 | 100.0° | 36.4° |
| C32 | C25 | C26 | H9 | 112.0° | 91.1° |
| C32 | C25 | C26 | H10 | 121.9° | 137.2° |
| C25 | C32 | N27 | S1 | 19.3° | 156.2° |
| C25 | C33 | C23 | H1 | 116.7° | 114.5° |
| C25 | C33 | C23 | H2 | 116.7° | 114.6° |
| C33 | C25 | C24 | C23 | 19.6° | 24.8° |
| C25 | C33 | C23 | O22 | 136.2° | 139.2° |
| C25 | C33 | H1 | H2 | 128.8° | 131.5° |
| C33 | C25 | C32 | H3 | 2.1° | 97.3° |
| C33 | C25 | C32 | H4 | 124.1° | 34.2° |
| C25 | C33 | C23 | H6 | 89.5° | 90.0° |
| C33 | C25 | C24 | H7 | 97.1° | 139.3° |
| C33 | C25 | C24 | H8 | 136.3° | 89.7° |
| C33 | C25 | C26 | H9 | 125.2° | 34.4° |
| C33 | C25 | C26 | H10 | 0.9° | 97.3° |
| C25 | C24 | C23 | H7 | 116.7° | 114.5° |
| C25 | C24 | C23 | H8 | 116.7° | 114.5° |
| C25 | C24 | C23 | O22 | 143.8° | 139.3° |
| C24 | C25 | C33 | H1 | 136.4° | 89.6° |
| C24 | C25 | C33 | H2 | 97.1° | 139.3° |
| C24 | C25 | C32 | H3 | 108.6° | 11.8° |
| C24 | C25 | C32 | H4 | 17.6° | 143.2° |
| C25 | C24 | C23 | H6 | 89.6° | 90.0° |
| C25 | C24 | H7 | H8 | 128.9° | 131.4° |
| C24 | C25 | C26 | H9 | 15.1° | 143.3° |
| C24 | C25 | C26 | H10 | 111.0° | 11.7° |
| C33 | C23 | C24 | O22 | 124.4° | 114.6° |
| C33 | C23 | C24 | H6 | 109.0° | 114.6° |
| C33 | C23 | O22 | H6 | 133.4° | 131.1° |
| C33 | C23 | O22 | C02 | 136.0° | 150.0° |
| C23 | C33 | H1 | H2 | 128.9° | 131.3° |
| C33 | C23 | C24 | H7 | 97.3° | 139.1° |
| C33 | C23 | C24 | H8 | 136.1° | 89.9° |
| C14 | N15 | C16 | H31 | 180.0° | 180.0° |
| N15 | C14 | C13 | C12 | 131.3° | 134.9° |
| N15 | C14 | C13 | C17 | 11.5° | 16.3° |
| C14 | N15 | C16 | C17 | 10.8° | 17.0° |
| C14 | N15 | C16 | H14 | 108.4° | 136.0° |
| C14 | N15 | C16 | H15 | 130.0° | 102.0° |
| N15 | C14 | C13 | H19 | 106.8° | 102.5° |
| C13 | C14 | N15 | C16 | 0.4° | 0.4° |
| C14 | C13 | C12 | C17 | 114.9° | 114.7° |
| C14 | C13 | C12 | H19 | 122.2° | 122.7° |
| C14 | C13 | C17 | H19 | 118.5° | 118.9° |
| C14 | C13 | C17 | C16 | 17.4° | 24.8° |
| C14 | C13 | C12 | C11 | 178.3° | 179.9° |
| C14 | C13 | C17 | H11 | 102.0° | 142.9° |
| C14 | C13 | C17 | H12 | 136.8° | 93.3° |
| C14 | C13 | C12 | H17 | 61.5° | 60.0° |
| C14 | C13 | C12 | H18 | 58.0° | 60.1° |
| C13 | C14 | N15 | H31 | 179.6° | 179.6° |
| N15 | C16 | C17 | C13 | 17.4° | 25.4° |
| N15 | C16 | C17 | H14 | 119.2° | 119.0° |
| N15 | C16 | C17 | H15 | 119.2° | 119.1° |
| N15 | C16 | C17 | H11 | 102.1° | 143.5° |
| N15 | C16 | C17 | H12 | 136.8° | 92.7° |
| N15 | C16 | H14 | H15 | 122.2° | 122.0° |
| C24 | C23 | O22 | H6 | 125.5° | 131.1° |
| C24 | C23 | O22 | C02 | 123.0° | 112.3° |
| C24 | C23 | C33 | H1 | 136.1° | 89.9° |
| C24 | C23 | C33 | H2 | 97.3° | 139.2° |
| C23 | C24 | H7 | H8 | 128.9° | 131.4° |
| C23 | O22 | C02 | O01 | 22.5° | 0.1° |
| C23 | O22 | C02 | N03 | 158.2° | 180.0° |
| O22 | C23 | C33 | H1 | 107.1° | 24.7° |
| O22 | C23 | C33 | H2 | 19.5° | 106.2° |
| O22 | C23 | C24 | H7 | 27.0° | 106.3° |
| O22 | C23 | C24 | H8 | 99.5° | 24.8° |
| O01 | C02 | O22 | N03 | 179.3° | 180.0° |
| O01 | C02 | N03 | C04 | 14.5° | 5.1° |
| O01 | C02 | N03 | H30 | 165.5° | 175.0° |
| C12 | C13 | C17 | H19 | 122.9° | 122.5° |
| C12 | C13 | C17 | C16 | 136.0° | 143.5° |
| C13 | C12 | C11 | H17 | 120.3° | 120.0° |
| C13 | C12 | C11 | H18 | 120.3° | 120.0° |
| C13 | C12 | C11 | N10 | 66.0° | 66.2° |
| C13 | C12 | C11 | C19 | 172.6° | 173.9° |
| C12 | C13 | C17 | H11 | 16.6° | 98.5° |
| C12 | C13 | C17 | H12 | 104.5° | 25.3° |
| C13 | C12 | C11 | H16 | 53.9° | 53.9° |
| C13 | C12 | H17 | H18 | 119.2° | 120.0° |
| C13 | C17 | C16 | H11 | 119.4° | 118.1° |
| C13 | C17 | C16 | H12 | 119.4° | 118.2° |
| C17 | C13 | C12 | C11 | 66.9° | 65.4° |
| C13 | C17 | H11 | H12 | 121.7° | 123.8° |
| C13 | C17 | C16 | H14 | 101.9° | 144.4° |
| C13 | C17 | C16 | H15 | 136.6° | 93.6° |
| C17 | C13 | C12 | H17 | 53.4° | 174.7° |
| C17 | C13 | C12 | H18 | 172.9° | 54.6° |
| O22 | C02 | N03 | C04 | 164.7° | 175.0° |
| C02 | O22 | C23 | H6 | 2.6° | 18.8° |
| O22 | C02 | N03 | H30 | 15.2° | 5.0° |
| C02 | N03 | C04 | H30 | 180.0° | 180.0° |
| C02 | N03 | C04 | C09 | 60.5° | 151.8° |
| C02 | N03 | C04 | C05 | 179.0° | 88.2° |
| C02 | N03 | C04 | H20 | 60.4° | 31.9° |
| C16 | C17 | H11 | H12 | 121.7° | 123.8° |
| C17 | C16 | H14 | H15 | 122.3° | 121.9° |
| C16 | C17 | C13 | H19 | 101.1° | 94.0° |
| C17 | C16 | N15 | H31 | 169.2° | 163.0° |
| C12 | C11 | C19 | SG | 63.2° | 65.0° |
| C12 | C11 | N10 | C19 | 121.6° | 119.9° |
| C12 | C11 | N10 | H16 | 119.2° | 120.0° |
| C12 | C11 | N10 | C09 | 133.7° | 157.3° |
| C12 | C11 | C19 | H16 | 118.7° | 120.0° |
| C12 | C11 | C19 | O20 | 57.4° | 55.0° |
| C12 | C11 | N10 | H5 | 46.3° | 22.7° |
| C12 | C11 | C19 | H13 | 179.1° | 175.0° |
| C11 | C12 | H17 | H18 | 119.2° | 120.0° |
| C11 | C12 | C13 | H19 | 56.0° | 57.2° |
| N03 | C04 | C09 | N10 | 120.1° | 163.1° |
| N03 | C04 | C09 | C05 | 120.1° | 120.0° |
| N03 | C04 | C09 | H20 | 121.5° | 120.0° |
| N03 | C04 | C05 | H20 | 121.2° | 120.0° |
| N03 | C04 | C09 | O21 | 59.9° | 16.9° |
| N03 | C04 | C05 | C06 | 76.4° | 171.4° |
| N03 | C04 | C05 | H21 | 44.3° | 51.4° |
| N03 | C04 | C05 | H22 | 162.9° | 68.6° |
| SG | C19 | C11 | N10 | 58.2° | 55.0° |
| SG | C19 | C11 | O20 | 120.6° | 120.0° |
| SG | C19 | C11 | H13 | 117.7° | 120.0° |
| SG | C19 | O20 | H13 | 119.7° | 120.0° |
| SG | C19 | C11 | H16 | 178.1° | 175.0° |
| SG | C19 | O20 | H34 | 180.0° | 60.0° |
| C19 | SG | O2 | O1 | 101.7° | 116.0° |
| C19 | SG | O2 | O3 | 90.0° | 116.1° |
| C19 | SG | O1 | O3 | 135.8° | 131.5° |
| C19 | SG | O2 | H32 | 90.0° | 180.0° |
| C07 | C06 | C05 | C04 | 76.1° | 67.3° |
| C07 | C06 | C05 | C08 | 120.2° | 120.0° |
| C07 | C06 | C05 | H23 | 119.9° | 120.0° |
| C07 | C06 | C08 | H23 | 117.6° | 120.0° |
| C07 | C06 | C05 | H21 | 163.1° | 52.6° |
| C07 | C06 | C05 | H22 | 44.6° | 172.6° |
| C06 | C07 | H24 | H25 | 120.0° | 120.0° |
| C06 | C07 | H24 | H26 | 120.0° | 120.0° |
| C06 | C07 | H25 | H26 | 120.0° | 120.0° |
| C07 | C06 | C08 | H27 | 180.0° | 180.0° |
| C07 | C06 | C08 | H28 | 60.0° | 60.0° |
| C07 | C06 | C08 | H29 | 60.0° | 60.0° |
| C11 | N10 | C09 | H5 | 180.0° | 180.0° |
| C11 | N10 | C09 | C04 | 179.1° | 174.2° |
| N10 | C11 | C19 | H16 | 119.9° | 120.0° |
| C11 | N10 | C09 | O21 | 0.8° | 5.8° |
| N10 | C11 | C19 | O20 | 178.8° | 175.0° |
| N10 | C11 | C19 | H13 | 59.5° | 65.1° |
| N10 | C11 | C12 | H17 | 173.7° | 53.8° |
| N10 | C11 | C12 | H18 | 54.2° | 173.9° |
| N10 | C09 | C04 | O21 | 179.9° | 180.0° |
| N10 | C09 | C04 | C05 | 119.7° | 76.9° |
| C09 | N10 | C11 | C19 | 104.7° | 82.8° |
| C09 | N10 | C11 | H16 | 14.5° | 37.2° |
| N10 | C09 | C04 | H20 | 1.4° | 43.1° |
| C09 | C04 | C05 | H20 | 118.2° | 120.0° |
| C09 | C04 | C05 | C06 | 162.9° | 68.7° |
| C04 | C09 | N10 | H5 | 0.8° | 5.8° |
| C09 | C04 | C05 | H21 | 76.3° | 171.4° |
| C09 | C04 | C05 | H22 | 42.2° | 51.3° |
| C09 | C04 | N03 | H30 | 119.5° | 28.2° |
| C05 | C04 | C09 | O21 | 60.2° | 103.0° |
| C04 | C05 | C06 | H21 | 120.7° | 120.0° |
| C04 | C05 | C06 | H22 | 120.7° | 120.0° |
| C04 | C05 | C06 | C08 | 163.6° | 172.6° |
| C04 | C05 | H21 | H22 | 117.8° | 120.0° |
| C04 | C05 | C06 | H23 | 43.8° | 52.6° |
| C05 | C04 | N03 | H30 | 1.0° | 91.8° |
| C11 | C19 | O20 | H13 | 120.3° | 120.0° |
| C19 | C11 | N10 | H5 | 75.3° | 97.2° |
| C19 | C11 | C12 | H17 | 52.3° | 66.2° |
| C19 | C11 | C12 | H18 | 67.2° | 53.9° |
| C11 | C19 | O20 | H34 | 60.0° | 60.0° |
| C11 | C19 | SG | O2 | 75.5° | 175.0° |
| C11 | C19 | SG | O1 | 169.1° | 63.4° |
| C11 | C19 | SG | O3 | 75.5° | 73.4° |
| O21 | C09 | N10 | H5 | 179.2° | 174.2° |
| O21 | C09 | C04 | H20 | 178.5° | 136.9° |
| C05 | C06 | C08 | H23 | 119.8° | 120.0° |
| C06 | C05 | C04 | H20 | 44.8° | 51.3° |
| C06 | C05 | H21 | H22 | 117.7° | 120.0° |
| C05 | C06 | C07 | H24 | 180.0° | 176.3° |
| C05 | C06 | C07 | H25 | 60.0° | 56.4° |
| C05 | C06 | C07 | H26 | 60.0° | 63.6° |
| C05 | C06 | C08 | H27 | 57.4° | 60.0° |
| C05 | C06 | C08 | H28 | 62.6° | 180.0° |
| C05 | C06 | C08 | H29 | 177.4° | 60.0° |
| C08 | C06 | C05 | H21 | 42.9° | 67.4° |
| C08 | C06 | C05 | H22 | 75.6° | 52.6° |
| C08 | C06 | C07 | H24 | 57.4° | 63.7° |
| C08 | C06 | C07 | H25 | 62.6° | 176.4° |
| C08 | C06 | C07 | H26 | 177.4° | 56.4° |
| C06 | C08 | H27 | H28 | 120.0° | 120.1° |
| C06 | C08 | H27 | H29 | 120.0° | 120.0° |
| C06 | C08 | H28 | H29 | 120.0° | 120.0° |
| O20 | C19 | C11 | H16 | 61.3° | 65.0° |
| O20 | C19 | SG | O2 | 42.5° | 55.0° |
| O20 | C19 | SG | O1 | 51.1° | 56.6° |
| O20 | C19 | SG | O3 | 42.5° | 166.6° |
| H1 | C33 | C23 | H6 | 27.2° | 155.6° |
| H2 | C33 | C23 | H6 | 153.8° | 24.7° |
| H3 | C32 | N27 | S1 | 136.1° | 41.9° |
| H4 | C32 | N27 | S1 | 97.6° | 89.6° |
| H5 | N10 | C11 | H16 | 165.5° | 142.8° |
| H6 | C23 | C24 | H7 | 153.7° | 24.5° |
| H6 | C23 | C24 | H8 | 27.1° | 155.5° |
| H9 | C26 | N27 | S1 | 46.7° | 89.7° |
| H10 | C26 | N27 | S1 | 79.4° | 41.9° |
| H11 | C17 | C16 | H14 | 138.7° | 97.5° |
| H11 | C17 | C16 | H15 | 17.1° | 24.4° |
| H11 | C17 | C13 | H19 | 139.5° | 24.0° |
| H12 | C17 | C16 | H14 | 17.6° | 26.3° |
| H12 | C17 | C16 | H15 | 104.0° | 148.2° |
| H12 | C17 | C13 | H19 | 18.3° | 147.8° |
| H13 | C19 | C11 | H16 | 60.5° | 55.0° |
| H13 | C19 | O20 | H34 | 60.3° | 180.0° |
| H13 | C19 | SG | O2 | 165.1° | 65.0° |
| H13 | C19 | SG | O1 | 71.5° | 176.6° |
| H13 | C19 | SG | O3 | 165.1° | 46.6° |
| H14 | C16 | N15 | H31 | 71.5° | 44.0° |
| H15 | C16 | N15 | H31 | 50.0° | 78.0° |
| H16 | C11 | C12 | H17 | 66.3° | 173.8° |
| H16 | C11 | C12 | H18 | 174.2° | 66.1° |
| H17 | C12 | C13 | H19 | 176.3° | 62.8° |
| H18 | C12 | C13 | H19 | 64.3° | 177.2° |
| H20 | C04 | C05 | H21 | 165.5° | 68.6° |
| H20 | C04 | C05 | H22 | 75.9° | 171.4° |
| H20 | C04 | N03 | H30 | 119.6° | 148.2° |
| H21 | C05 | C06 | H23 | 76.9° | 172.6° |
| H22 | C05 | C06 | H23 | 164.5° | 67.4° |
| H23 | C06 | C07 | H24 | 60.2° | 56.4° |
| H23 | C06 | C07 | H25 | 179.9° | 63.6° |
| H23 | C06 | C07 | H26 | 59.9° | 176.4° |
| H23 | C06 | C08 | H27 | 62.4° | 60.0° |
| H23 | C06 | C08 | H28 | 177.6° | 60.0° |
| H23 | C06 | C08 | H29 | 57.6° | 180.0° |
| H24 | C07 | H25 | H26 | 120.0° | 120.1° |
| H27 | C08 | H28 | H29 | 120.0° | 120.0° |
| O2 | SG | O1 | O3 | NaN° | 116.8° |
| O1 | SG | O2 | H32 | 90.0° | 64.0° |
| O3 | SG | O2 | H32 | 90.0° | 63.9° |
| N27 | S1 | C1 | O5 | 90.0° | 111.6° |
| N27 | S1 | C1 | O4 | 90.0° | 111.7° |
| N27 | S1 | O5 | O4 | 90.0° | 116.8° |
| N27 | S1 | C1 | H33 | 90.0° | 59.9° |
| N27 | S1 | C1 | H35 | 90.0° | 180.0° |
| N27 | S1 | C1 | H36 | 90.0° | 60.0° |
| C1 | S1 | O5 | O4 | 90.0° | 131.5° |
| S1 | C1 | H33 | H35 | 90.0° | 120.0° |
| S1 | C1 | H33 | H36 | 90.0° | 119.9° |
| S1 | C1 | H35 | H36 | 90.0° | 120.0° |
| O5 | S1 | C1 | H33 | 90.0° | 51.7° |
| O5 | S1 | C1 | H35 | 90.0° | 68.4° |
| O5 | S1 | C1 | H36 | 90.0° | 171.6° |
| O4 | S1 | C1 | H33 | 90.0° | 171.6° |
| O4 | S1 | C1 | H35 | 90.0° | 68.4° |
| O4 | S1 | C1 | H36 | 90.0° | 51.6° |
| H33 | C1 | H35 | H36 | 90.0° | 120.0° |
