I55
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | N1 | sing | 1.47Å | 1.48Å | |
| C1 | C2 | sing | 1.51Å | 1.50Å | |
| C2 | O1 | doub | 1.21Å | 1.23Å | |
| C2 | N2 | sing | 1.35Å | 1.33Å | |
| O8 | C15 | sing | 1.43Å | 1.42Å | |
| O7 | C14 | doub | 1.21Å | 1.21Å | |
| N2 | C3 | sing | 1.46Å | 1.45Å | |
| C15 | C3 | sing | 1.53Å | 1.52Å | |
| C15 | C13 | sing | 1.53Å | 1.52Å | |
| C14 | N7 | sing | 1.35Å | 1.36Å | |
| C14 | O6 | sing | 1.35Å | 1.34Å | |
| C3 | C4 | sing | 1.53Å | 1.50Å | |
| C13 | O6 | sing | 1.45Å | 1.45Å | |
| C13 | C11 | sing | 1.53Å | 1.52Å | |
| C4 | N3 | sing | 1.46Å | 1.44Å | |
| C4 | O4 | sing | 1.43Å | 1.41Å | |
| C11 | O4 | sing | 1.43Å | 1.43Å | |
| C11 | C12 | sing | 1.53Å | 1.50Å | |
| O3 | C9 | sing | 1.43Å | 1.44Å | |
| N3 | C5 | doub | 1.30Å | 1.31Å | |
| N6 | C5 | sing | 1.39Å | 1.38Å | |
| N6 | C10 | sing | 1.45Å | 1.46Å | |
| C5 | N4 | sing | 1.39Å | 1.37Å | |
| C12 | O5 | sing | 1.43Å | 1.42Å | |
| C9 | C10 | sing | 1.51Å | 1.53Å | |
| C9 | C8 | sing | 1.53Å | 1.53Å | |
| N4 | C6 | sing | 1.45Å | 1.46Å | |
| C6 | C10 | sing | 1.56Å | 1.54Å | |
| C6 | C7 | sing | 1.50Å | 1.51Å | |
| C8 | N5 | sing | 1.45Å | 1.47Å | |
| C7 | N5 | sing | 1.36Å | 1.34Å | |
| C7 | O2 | doub | 1.21Å | 1.23Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C6 | H2 | sing | 1.09Å | 1.10Å | |
| C11 | H3 | sing | 1.09Å | 1.10Å | |
| C8 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C9 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.09Å | 1.10Å | |
| N1 | H11 | sing | 1.01Å | 1.00Å | |
| N1 | H12 | sing | 1.01Å | 1.00Å | |
| N2 | H14 | sing | 0.97Å | 1.00Å | |
| C3 | H15 | sing | 1.09Å | 1.10Å | |
| C1 | H16 | sing | 1.09Å | 1.10Å | |
| C1 | H17 | sing | 1.09Å | 1.10Å | |
| N4 | H18 | sing | 0.97Å | 1.00Å | |
| N5 | H19 | sing | 0.97Å | 1.00Å | |
| O3 | H20 | sing | 0.97Å | 0.95Å | |
| N6 | H21 | sing | 0.97Å | 1.00Å | |
| O5 | H22 | sing | 0.97Å | 0.95Å | |
| N7 | H23 | sing | 0.97Å | 1.00Å | |
| N7 | H24 | sing | 0.97Å | 1.00Å | |
| C15 | H25 | sing | 1.09Å | 1.10Å | |
| O8 | H26 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N1 | C1 | C2 | 106.6° | 109.4° |
| C1 | N1 | H11 | 109.5° | 111.0° |
| C1 | N1 | H12 | 109.5° | 111.0° |
| N1 | C1 | H16 | 110.2° | 109.4° |
| N1 | C1 | H17 | 110.2° | 109.5° |
| C1 | C2 | O1 | 120.0° | 120.0° |
| C1 | C2 | N2 | 116.7° | 119.9° |
| C2 | C1 | H16 | 110.2° | 109.4° |
| C2 | C1 | H17 | 110.2° | 109.5° |
| O1 | C2 | N2 | 123.0° | 120.0° |
| C2 | N2 | C3 | 123.4° | 120.0° |
| C2 | N2 | H14 | 118.3° | 120.0° |
| O8 | C15 | C3 | 107.3° | 109.5° |
| O8 | C15 | C13 | 110.7° | 109.5° |
| O8 | C15 | H25 | 110.6° | 109.6° |
| C15 | O8 | H26 | 109.5° | 114.0° |
| O7 | C14 | N7 | 125.1° | 120.0° |
| O7 | C14 | O6 | 123.3° | 120.0° |
| N2 | C3 | C15 | 109.2° | 109.5° |
| N2 | C3 | C4 | 112.0° | 109.5° |
| C3 | N2 | H14 | 118.3° | 120.0° |
| N2 | C3 | H15 | 108.9° | 109.5° |
| C3 | C15 | C13 | 109.7° | 109.1° |
| C15 | C3 | C4 | 110.6° | 109.2° |
| C15 | C3 | H15 | 107.9° | 109.6° |
| C3 | C15 | H25 | 109.2° | 109.5° |
| C15 | C13 | O6 | 110.1° | 109.6° |
| C15 | C13 | C11 | 108.5° | 109.1° |
| C15 | C13 | H10 | 109.6° | 109.6° |
| C13 | C15 | H25 | 109.3° | 109.5° |
| N7 | C14 | O6 | 111.5° | 120.0° |
| C14 | N7 | H23 | 120.0° | 120.0° |
| C14 | N7 | H24 | 120.0° | 120.0° |
| C14 | O6 | C13 | 116.7° | 117.0° |
| C3 | C4 | N3 | 108.6° | 109.5° |
| C3 | C4 | O4 | 111.5° | 109.4° |
| C3 | C4 | H1 | 109.8° | 109.4° |
| C4 | C3 | H15 | 108.2° | 109.5° |
| O6 | C13 | C11 | 108.3° | 109.4° |
| O6 | C13 | H10 | 110.6° | 109.6° |
| C13 | C11 | O4 | 110.5° | 109.4° |
| C13 | C11 | C12 | 113.6° | 109.5° |
| C13 | C11 | H3 | 108.3° | 109.4° |
| C11 | C13 | H10 | 109.7° | 109.5° |
| N3 | C4 | O4 | 105.1° | 109.5° |
| C4 | N3 | C5 | 125.5° | 120.0° |
| N3 | C4 | H1 | 110.7° | 109.5° |
| C4 | O4 | C11 | 115.2° | 114.1° |
| O4 | C4 | H1 | 111.0° | 109.5° |
| O4 | C11 | C12 | 106.2° | 109.5° |
| O4 | C11 | H3 | 109.5° | 109.5° |
| C11 | C12 | O5 | 106.8° | 109.5° |
| C12 | C11 | H3 | 108.7° | 109.5° |
| C11 | C12 | H8 | 110.1° | 109.5° |
| C11 | C12 | H9 | 110.1° | 109.5° |
| O3 | C9 | C10 | 111.3° | 109.5° |
| O3 | C9 | C8 | 109.7° | 109.5° |
| O3 | C9 | H6 | 109.6° | 109.5° |
| C9 | O3 | H20 | 109.5° | 114.0° |
| N3 | C5 | N6 | 127.5° | 124.4° |
| N3 | C5 | N4 | 124.0° | 124.5° |
| C5 | N6 | C10 | 108.5° | 104.6° |
| N6 | C5 | N4 | 108.5° | 111.1° |
| C5 | N6 | H21 | 125.8° | 127.7° |
| N6 | C10 | C9 | 123.5° | 119.1° |
| N6 | C10 | C6 | 98.7° | 100.8° |
| N6 | C10 | H7 | 110.2° | 110.0° |
| C10 | N6 | H21 | 125.7° | 127.7° |
| C5 | N4 | C6 | 108.3° | 107.4° |
| C5 | N4 | H18 | 125.9° | 126.3° |
| O5 | C12 | H8 | 110.1° | 109.4° |
| O5 | C12 | H9 | 110.1° | 109.5° |
| C12 | O5 | H22 | 109.5° | 114.1° |
| C10 | C9 | C8 | 109.2° | 109.4° |
| C9 | C10 | C6 | 105.0° | 106.6° |
| C10 | C9 | H6 | 108.5° | 109.5° |
| C9 | C10 | H7 | 109.1° | 109.8° |
| C9 | C8 | N5 | 111.7° | 114.9° |
| C9 | C8 | H4 | 108.9° | 108.3° |
| C9 | C8 | H5 | 108.9° | 108.3° |
| C8 | C9 | H6 | 108.5° | 109.4° |
| N4 | C6 | C10 | 100.8° | 101.7° |
| N4 | C6 | C7 | 120.3° | 118.4° |
| N4 | C6 | H2 | 109.8° | 110.8° |
| C6 | N4 | H18 | 125.8° | 126.3° |
| C10 | C6 | C7 | 107.2° | 103.5° |
| C10 | C6 | H2 | 108.8° | 110.9° |
| C6 | C10 | H7 | 109.0° | 109.8° |
| C6 | C7 | N5 | 116.9° | 113.4° |
| C6 | C7 | O2 | 119.6° | 123.3° |
| C7 | C6 | H2 | 109.2° | 110.7° |
| C8 | N5 | C7 | 127.8° | 123.1° |
| N5 | C8 | H4 | 108.9° | 108.4° |
| N5 | C8 | H5 | 108.9° | 108.4° |
| C8 | N5 | H19 | 116.1° | 118.5° |
| N5 | C7 | O2 | 123.5° | 123.3° |
| C7 | N5 | H19 | 116.1° | 118.4° |
| H4 | C8 | H5 | 109.5° | 108.3° |
| H8 | C12 | H9 | 109.5° | 109.5° |
| H11 | N1 | H12 | 109.5° | 111.0° |
| H16 | C1 | H17 | 109.4° | 109.5° |
| H23 | N7 | H24 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C1 | C2 | H16 | 119.6° | 119.9° |
| N1 | C1 | C2 | H17 | 119.6° | 120.0° |
| N1 | C1 | C2 | O1 | 21.7° | 0.0° |
| N1 | C1 | C2 | N2 | 152.7° | 180.0° |
| C1 | N1 | H11 | H12 | 120.0° | 124.0° |
| N1 | C1 | H16 | H17 | 121.3° | 120.0° |
| C1 | C2 | O1 | N2 | 174.1° | 180.0° |
| C1 | C2 | N2 | C3 | 177.0° | 180.0° |
| C2 | C1 | N1 | H11 | 180.0° | 180.0° |
| C2 | C1 | N1 | H12 | 60.0° | 56.1° |
| C1 | C2 | N2 | H14 | 3.0° | 0.1° |
| C2 | C1 | H16 | H17 | 121.3° | 120.1° |
| O1 | C2 | N2 | C3 | 2.7° | 0.0° |
| O1 | C2 | N2 | H14 | 177.3° | 179.9° |
| O1 | C2 | C1 | H16 | 141.3° | 119.9° |
| O1 | C2 | C1 | H17 | 97.8° | 120.0° |
| C2 | N2 | C3 | H14 | 180.0° | 179.9° |
| C2 | N2 | C3 | C15 | 104.1° | 155.3° |
| C2 | N2 | C3 | C4 | 133.2° | 85.0° |
| C2 | N2 | C3 | H15 | 13.5° | 35.1° |
| N2 | C2 | C1 | H16 | 33.1° | 60.1° |
| N2 | C2 | C1 | H17 | 87.8° | 60.0° |
| O8 | C15 | C3 | N2 | 58.5° | 57.0° |
| O8 | C15 | C3 | C13 | 120.3° | 119.9° |
| O8 | C15 | C3 | H25 | 119.9° | 120.2° |
| O8 | C15 | C13 | H25 | 122.0° | 120.2° |
| O8 | C15 | C3 | C4 | 65.1° | 62.9° |
| O8 | C15 | C13 | O6 | 179.9° | 177.3° |
| O8 | C15 | C13 | C11 | 61.6° | 62.9° |
| O8 | C15 | C13 | H10 | 58.2° | 57.0° |
| O8 | C15 | C3 | H15 | 176.7° | 177.2° |
| O7 | C14 | N7 | O6 | 178.9° | 179.9° |
| O7 | C14 | O6 | C13 | 11.6° | 0.1° |
| O7 | C14 | N7 | H23 | 0.0° | 180.0° |
| O7 | C14 | N7 | H24 | 180.0° | 0.0° |
| N2 | C3 | C15 | C4 | 123.6° | 119.9° |
| N2 | C3 | C15 | H15 | 118.2° | 120.2° |
| N2 | C3 | C15 | C13 | 178.9° | 176.9° |
| N2 | C3 | C4 | H15 | 120.0° | 120.1° |
| N2 | C3 | C4 | N3 | 69.3° | 62.5° |
| N2 | C3 | C4 | O4 | 175.3° | 177.5° |
| N2 | C3 | C4 | H1 | 51.8° | 57.5° |
| N2 | C3 | C15 | H25 | 61.4° | 63.2° |
| C3 | C15 | C13 | H25 | 119.7° | 119.9° |
| C15 | C3 | C4 | H15 | 118.0° | 119.9° |
| C3 | C15 | C13 | O6 | 61.6° | 62.8° |
| C3 | C15 | C13 | C11 | 56.7° | 57.0° |
| C15 | C3 | C4 | N3 | 168.7° | 177.6° |
| C15 | C3 | C4 | O4 | 53.3° | 57.6° |
| C15 | C3 | C4 | H1 | 70.2° | 62.4° |
| C3 | C15 | C13 | H10 | 176.5° | 176.9° |
| C15 | C3 | N2 | H14 | 75.9° | 24.7° |
| C3 | C15 | O8 | H26 | 180.0° | 179.9° |
| C15 | C13 | O6 | C14 | 72.8° | 150.3° |
| C13 | C15 | C3 | C4 | 55.3° | 57.0° |
| C15 | C13 | O6 | C11 | 118.5° | 119.6° |
| C15 | C13 | O6 | H10 | 121.3° | 120.3° |
| C15 | C13 | C11 | H10 | 119.7° | 120.0° |
| C15 | C13 | C11 | O4 | 57.0° | 57.5° |
| C15 | C13 | C11 | C12 | 176.2° | 177.6° |
| C15 | C13 | C11 | H3 | 62.9° | 62.4° |
| C13 | C15 | C3 | H15 | 63.0° | 62.9° |
| C13 | C15 | O8 | H26 | 60.3° | 60.4° |
| N7 | C14 | O6 | C13 | 167.3° | 180.0° |
| C14 | N7 | H23 | H24 | 180.0° | 180.0° |
| C14 | O6 | C13 | C11 | 168.7° | 90.1° |
| C14 | O6 | C13 | H10 | 48.5° | 30.0° |
| O6 | C14 | N7 | H23 | 178.9° | 0.0° |
| O6 | C14 | N7 | H24 | 1.1° | 180.0° |
| C3 | C4 | N3 | O4 | 119.5° | 120.0° |
| C3 | C4 | N3 | H1 | 120.6° | 120.0° |
| C3 | C4 | O4 | H1 | 122.8° | 119.9° |
| C3 | C4 | O4 | C11 | 55.8° | 61.1° |
| C3 | C4 | N3 | C5 | 127.4° | 120.1° |
| C4 | C3 | N2 | H14 | 46.8° | 95.0° |
| C4 | C3 | C15 | H25 | 175.0° | 176.8° |
| O6 | C13 | C11 | H10 | 120.8° | 120.1° |
| O6 | C13 | C11 | O4 | 62.4° | 62.3° |
| O6 | C13 | C11 | C12 | 56.8° | 57.7° |
| O6 | C13 | C11 | H3 | 177.6° | 177.7° |
| O6 | C13 | C15 | H25 | 58.1° | 57.0° |
| C13 | C11 | O4 | C4 | 57.9° | 61.1° |
| C13 | C11 | O4 | C12 | 123.6° | 120.0° |
| C13 | C11 | O4 | H3 | 119.3° | 119.9° |
| C13 | C11 | C12 | H3 | 120.6° | 120.0° |
| C13 | C11 | C12 | O5 | 176.9° | 175.0° |
| C13 | C11 | C12 | H8 | 57.4° | 55.1° |
| C13 | C11 | C12 | H9 | 63.5° | 65.0° |
| C11 | C13 | C15 | H25 | 176.4° | 176.9° |
| N3 | C4 | O4 | H1 | 119.7° | 120.1° |
| N3 | C4 | O4 | C11 | 173.3° | 178.9° |
| C4 | N3 | C5 | N6 | 7.5° | 0.3° |
| C4 | N3 | C5 | N4 | 173.0° | 180.0° |
| N3 | C4 | C3 | H15 | 50.7° | 57.6° |
| C4 | O4 | C11 | C12 | 178.5° | 178.9° |
| O4 | C4 | N3 | C5 | 113.1° | 120.0° |
| C4 | O4 | C11 | H3 | 61.3° | 58.8° |
| O4 | C4 | C3 | H15 | 64.7° | 62.4° |
| O4 | C11 | C12 | H3 | 117.7° | 120.0° |
| O4 | C11 | C12 | O5 | 61.4° | 65.0° |
| C11 | O4 | C4 | H1 | 67.0° | 58.8° |
| O4 | C11 | C12 | H8 | 179.0° | 175.1° |
| O4 | C11 | C12 | H9 | 58.1° | 55.0° |
| O4 | C11 | C13 | H10 | 176.8° | 177.5° |
| C11 | C12 | O5 | H8 | 119.6° | 120.0° |
| C11 | C12 | O5 | H9 | 119.6° | 120.0° |
| C11 | C12 | H8 | H9 | 121.3° | 120.0° |
| C12 | C11 | C13 | H10 | 64.0° | 62.4° |
| C11 | C12 | O5 | H22 | 180.0° | 180.0° |
| O3 | C9 | C10 | N6 | 58.0° | 43.9° |
| O3 | C9 | C10 | C8 | 121.2° | 120.0° |
| O3 | C9 | C10 | H6 | 120.7° | 120.1° |
| O3 | C9 | C8 | H6 | 119.7° | 120.0° |
| O3 | C9 | C10 | C6 | 53.4° | 69.1° |
| O3 | C9 | C8 | N5 | 87.3° | 121.4° |
| O3 | C9 | C8 | H4 | 33.0° | 0.0° |
| O3 | C9 | C8 | H5 | 152.4° | 117.2° |
| O3 | C9 | C10 | H7 | 170.2° | 172.0° |
| N3 | C5 | N6 | N4 | 179.6° | 179.7° |
| N3 | C5 | N6 | C10 | 161.9° | 155.1° |
| N3 | C5 | N4 | C6 | 171.8° | 179.0° |
| C5 | N3 | C4 | H1 | 6.9° | 0.1° |
| N3 | C5 | N4 | H18 | 8.2° | 1.0° |
| N3 | C5 | N6 | H21 | 18.1° | 24.9° |
| C5 | N6 | C10 | H21 | 180.0° | 180.0° |
| C5 | N6 | C10 | C9 | 148.8° | 152.3° |
| N6 | C5 | N4 | C6 | 8.7° | 1.3° |
| C5 | N6 | C10 | C6 | 34.3° | 36.3° |
| C5 | N6 | C10 | H7 | 79.8° | 79.7° |
| N6 | C5 | N4 | H18 | 171.3° | 178.7° |
| C10 | N6 | C5 | N4 | 17.7° | 25.2° |
| N6 | C10 | C9 | C6 | 111.4° | 113.0° |
| N6 | C10 | C9 | H7 | 131.8° | 128.1° |
| N6 | C10 | C9 | C8 | 179.2° | 163.9° |
| N6 | C10 | C6 | N4 | 37.0° | 34.9° |
| N6 | C10 | C6 | H7 | 115.0° | 116.0° |
| N6 | C10 | C6 | C7 | 163.6° | 158.3° |
| N6 | C10 | C6 | H2 | 78.5° | 83.0° |
| N6 | C10 | C9 | H6 | 62.7° | 76.2° |
| C5 | N4 | C6 | H18 | 180.0° | 180.0° |
| C5 | N4 | C6 | C10 | 29.3° | 21.2° |
| C5 | N4 | C6 | C7 | 146.7° | 133.7° |
| C5 | N4 | C6 | H2 | 85.3° | 96.8° |
| N4 | C5 | N6 | H21 | 162.3° | 154.8° |
| O5 | C12 | C11 | H3 | 56.3° | 55.0° |
| O5 | C12 | H8 | H9 | 121.2° | 120.0° |
| C10 | C9 | C8 | H6 | 118.1° | 120.0° |
| C9 | C10 | C6 | N4 | 165.2° | 159.9° |
| C9 | C10 | C6 | H7 | 116.8° | 118.9° |
| C9 | C10 | C6 | C7 | 68.2° | 76.7° |
| C10 | C9 | C8 | N5 | 34.9° | 1.4° |
| C9 | C10 | C6 | H2 | 49.7° | 42.1° |
| C10 | C9 | C8 | H4 | 155.2° | 119.9° |
| C10 | C9 | C8 | H5 | 85.4° | 122.8° |
| C10 | C9 | O3 | H20 | 180.0° | 180.0° |
| C9 | C10 | N6 | H21 | 31.2° | 27.7° |
| C8 | C9 | C10 | C6 | 67.8° | 51.0° |
| C9 | C8 | N5 | H4 | 120.3° | 121.3° |
| C9 | C8 | N5 | H5 | 120.3° | 121.3° |
| C9 | C8 | N5 | C7 | 3.0° | 35.4° |
| C9 | C8 | H4 | H5 | 119.0° | 117.2° |
| C8 | C9 | C10 | H7 | 48.9° | 68.0° |
| C9 | C8 | N5 | H19 | 177.0° | 144.6° |
| C8 | C9 | O3 | H20 | 59.1° | 60.1° |
| N4 | C6 | C10 | C7 | 126.6° | 123.4° |
| N4 | C6 | C10 | H2 | 115.5° | 117.9° |
| N4 | C6 | C7 | H2 | 128.3° | 129.6° |
| N4 | C6 | C7 | N5 | 151.4° | 156.8° |
| N4 | C6 | C7 | O2 | 28.5° | 23.3° |
| N4 | C6 | C10 | H7 | 78.0° | 81.1° |
| C10 | C6 | C7 | H2 | 117.7° | 118.9° |
| C10 | C6 | C7 | N5 | 37.4° | 45.3° |
| C10 | C6 | C7 | O2 | 142.6° | 134.8° |
| C6 | C10 | C9 | H6 | 174.1° | 170.8° |
| C10 | C6 | N4 | H18 | 150.7° | 158.8° |
| C6 | C10 | N6 | H21 | 145.7° | 143.7° |
| C6 | C7 | N5 | C8 | 4.7° | 8.6° |
| C6 | C7 | N5 | O2 | 179.9° | 179.9° |
| C7 | C6 | C10 | H7 | 48.6° | 42.2° |
| C7 | C6 | N4 | H18 | 33.3° | 46.3° |
| C6 | C7 | N5 | H19 | 175.3° | 171.4° |
| C8 | N5 | C7 | H19 | 180.0° | 180.0° |
| C8 | N5 | C7 | O2 | 175.2° | 171.3° |
| N5 | C8 | H4 | H5 | 119.0° | 117.5° |
| N5 | C8 | C9 | H6 | 153.0° | 118.5° |
| N5 | C7 | C6 | H2 | 80.3° | 73.7° |
| C7 | N5 | C8 | H4 | 123.4° | 85.9° |
| C7 | N5 | C8 | H5 | 117.3° | 156.7° |
| O2 | C7 | C6 | H2 | 99.8° | 106.3° |
| O2 | C7 | N5 | H19 | 4.7° | 8.7° |
| H1 | C4 | C3 | H15 | 171.8° | 177.6° |
| H2 | C6 | C10 | H7 | 166.5° | 161.0° |
| H2 | C6 | N4 | H18 | 94.7° | 83.2° |
| H3 | C11 | C12 | H8 | 63.2° | 64.9° |
| H3 | C11 | C12 | H9 | 175.9° | 175.1° |
| H3 | C11 | C13 | H10 | 56.8° | 57.6° |
| H4 | C8 | C9 | H6 | 86.7° | 120.1° |
| H4 | C8 | N5 | H19 | 56.7° | 94.1° |
| H5 | C8 | C9 | H6 | 32.7° | 2.9° |
| H5 | C8 | N5 | H19 | 62.7° | 23.3° |
| H6 | C9 | C10 | H7 | 69.1° | 51.9° |
| H6 | C9 | O3 | H20 | 60.0° | 59.9° |
| H7 | C10 | N6 | H21 | 100.2° | 100.4° |
| H8 | C12 | O5 | H22 | 60.4° | 60.0° |
| H9 | C12 | O5 | H22 | 60.4° | 60.0° |
| H10 | C13 | C15 | H25 | 63.8° | 63.2° |
| H11 | N1 | C1 | H16 | 60.4° | 60.1° |
| H11 | N1 | C1 | H17 | 60.4° | 59.9° |
| H12 | N1 | C1 | H16 | 59.6° | 63.9° |
| H12 | N1 | C1 | H17 | 179.6° | 176.1° |
| H14 | N2 | C3 | H15 | 166.5° | 144.9° |
| H15 | C3 | C15 | H25 | 56.8° | 56.9° |
| H25 | C15 | O8 | H26 | 61.0° | 59.7° |
