I60
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
O7 | C14 | doub | 1.21Å | 1.23Å | |
N6 | C14 | sing | 1.36Å | 1.34Å | |
N6 | C15 | sing | 1.45Å | 1.47Å | |
C14 | C13 | sing | 1.50Å | 1.51Å | |
C15 | C16 | sing | 1.53Å | 1.55Å | |
O5 | C10 | sing | 1.43Å | 1.41Å | |
C13 | N5 | sing | 1.46Å | 1.46Å | |
C13 | C17 | sing | 1.56Å | 1.54Å | |
N5 | C12 | sing | 1.39Å | 1.38Å | |
C17 | C16 | sing | 1.51Å | 1.53Å | |
C17 | N7 | sing | 1.45Å | 1.46Å | |
C16 | O8 | sing | 1.43Å | 1.44Å | |
C10 | C9 | sing | 1.53Å | 1.50Å | |
C12 | N4 | doub | 1.30Å | 1.31Å | |
C12 | N7 | sing | 1.39Å | 1.39Å | |
O6 | C9 | sing | 1.43Å | 1.44Å | |
O6 | C11 | sing | 1.43Å | 1.42Å | |
N4 | C11 | sing | 1.47Å | 1.44Å | |
C9 | C7 | sing | 1.53Å | 1.52Å | |
C11 | C5 | sing | 1.53Å | 1.48Å | |
O3 | C7 | sing | 1.45Å | 1.45Å | |
O3 | C8 | sing | 1.35Å | 1.35Å | |
N3 | C8 | sing | 1.35Å | 1.35Å | |
C7 | C6 | sing | 1.53Å | 1.52Å | |
C5 | C6 | sing | 1.53Å | 1.53Å | |
C5 | N2 | sing | 1.47Å | 1.44Å | |
C8 | O4 | doub | 1.21Å | 1.21Å | |
C6 | O2 | sing | 1.43Å | 1.43Å | |
N2 | C4 | sing | 1.35Å | 1.33Å | |
O1 | C4 | doub | 1.21Å | 1.22Å | |
C4 | C3 | sing | 1.51Å | 1.51Å | |
C1 | N1 | sing | 1.47Å | 1.47Å | |
C1 | C2 | sing | 1.53Å | 1.52Å | |
C3 | C2 | sing | 1.53Å | 1.52Å | |
N1 | H1 | sing | 1.01Å | 1.00Å | |
N1 | H2 | sing | 1.01Å | 1.00Å | |
C1 | H4 | sing | 1.09Å | 1.10Å | |
C1 | H5 | sing | 1.09Å | 1.10Å | |
C2 | H6 | sing | 1.09Å | 1.10Å | |
C2 | H7 | sing | 1.09Å | 1.10Å | |
C3 | H8 | sing | 1.09Å | 1.10Å | |
C3 | H9 | sing | 1.09Å | 1.10Å | |
N2 | H10 | sing | 0.97Å | 1.00Å | |
C5 | H11 | sing | 1.09Å | 1.10Å | |
C6 | H12 | sing | 1.09Å | 1.10Å | |
O2 | H13 | sing | 0.97Å | 0.95Å | |
C7 | H14 | sing | 1.09Å | 1.10Å | |
N3 | H15 | sing | 0.97Å | 1.00Å | |
N3 | H16 | sing | 0.97Å | 1.00Å | |
C9 | H17 | sing | 1.09Å | 1.10Å | |
C10 | H18 | sing | 1.09Å | 1.10Å | |
C10 | H19 | sing | 1.09Å | 1.10Å | |
O5 | H20 | sing | 0.97Å | 0.95Å | |
C11 | H21 | sing | 1.09Å | 1.10Å | |
N5 | H22 | sing | 0.97Å | 1.00Å | |
C13 | H23 | sing | 1.09Å | 1.10Å | |
N6 | H24 | sing | 0.97Å | 1.00Å | |
C15 | H25 | sing | 1.09Å | 1.10Å | |
C15 | H26 | sing | 1.09Å | 1.10Å | |
C16 | H27 | sing | 1.09Å | 1.10Å | |
O8 | H28 | sing | 0.97Å | 0.95Å | |
C17 | H29 | sing | 1.09Å | 1.10Å | |
N7 | H30 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O7 | C14 | N6 | 123.0° | 123.3° |
O7 | C14 | C13 | 119.8° | 123.3° |
C14 | N6 | C15 | 127.6° | 123.2° |
N6 | C14 | C13 | 117.2° | 113.5° |
C14 | N6 | H24 | 116.2° | 118.4° |
N6 | C15 | C16 | 112.1° | 114.8° |
C15 | N6 | H24 | 116.2° | 118.4° |
N6 | C15 | H25 | 108.8° | 108.4° |
N6 | C15 | H26 | 108.8° | 108.4° |
C14 | C13 | N5 | 119.6° | 117.4° |
C14 | C13 | C17 | 109.9° | 103.3° |
C14 | C13 | H23 | 109.2° | 111.9° |
C15 | C16 | C17 | 111.2° | 109.4° |
C15 | C16 | O8 | 109.8° | 109.5° |
C16 | C15 | H25 | 108.8° | 108.4° |
C16 | C15 | H26 | 108.8° | 108.5° |
C15 | C16 | H27 | 108.3° | 109.5° |
O5 | C10 | C9 | 103.9° | 109.5° |
O5 | C10 | H18 | 110.9° | 109.5° |
O5 | C10 | H19 | 110.9° | 109.5° |
C10 | O5 | H20 | 109.5° | 114.0° |
N5 | C13 | C17 | 98.6° | 100.2° |
C13 | N5 | C12 | 107.7° | 104.7° |
C13 | N5 | H22 | 126.1° | 127.7° |
N5 | C13 | H23 | 109.9° | 111.3° |
C13 | C17 | C16 | 107.4° | 106.9° |
C13 | C17 | N7 | 97.4° | 102.0° |
C17 | C13 | H23 | 108.8° | 111.7° |
C13 | C17 | H29 | 108.9° | 109.2° |
N5 | C12 | N4 | 122.7° | 124.4° |
N5 | C12 | N7 | 108.3° | 111.1° |
C12 | N5 | H22 | 126.1° | 127.6° |
C16 | C17 | N7 | 122.9° | 119.8° |
C17 | C16 | O8 | 109.2° | 109.5° |
C17 | C16 | H27 | 108.6° | 109.5° |
C16 | C17 | H29 | 109.0° | 109.3° |
C17 | N7 | C12 | 103.7° | 107.2° |
N7 | C17 | H29 | 110.0° | 109.1° |
C17 | N7 | H30 | 128.1° | 126.4° |
O8 | C16 | H27 | 109.8° | 109.5° |
C16 | O8 | H28 | 109.5° | 114.0° |
C10 | C9 | O6 | 105.8° | 109.5° |
C10 | C9 | C7 | 113.8° | 109.5° |
C10 | C9 | H17 | 108.8° | 109.5° |
C9 | C10 | H18 | 110.8° | 109.5° |
C9 | C10 | H19 | 110.8° | 109.5° |
N4 | C12 | N7 | 128.9° | 124.5° |
C12 | N4 | C11 | 128.7° | 120.0° |
C12 | N7 | H30 | 128.2° | 126.4° |
C9 | O6 | C11 | 113.9° | 114.1° |
O6 | C9 | C7 | 110.3° | 109.5° |
O6 | C9 | H17 | 109.6° | 109.5° |
O6 | C11 | N4 | 108.5° | 109.5° |
O6 | C11 | C5 | 107.7° | 109.5° |
O6 | C11 | H21 | 111.0° | 109.4° |
N4 | C11 | C5 | 108.6° | 109.5° |
N4 | C11 | H21 | 110.7° | 109.4° |
C9 | C7 | O3 | 107.8° | 109.6° |
C9 | C7 | C6 | 108.5° | 109.1° |
C9 | C7 | H14 | 110.5° | 109.6° |
C7 | C9 | H17 | 108.5° | 109.5° |
C11 | C5 | C6 | 112.2° | 109.1° |
C11 | C5 | N2 | 111.3° | 109.5° |
C11 | C5 | H11 | 108.0° | 109.5° |
C5 | C11 | H21 | 110.1° | 109.5° |
C7 | O3 | C8 | 117.2° | 117.0° |
O3 | C7 | C6 | 107.8° | 109.5° |
O3 | C7 | H14 | 111.5° | 109.5° |
O3 | C8 | N3 | 111.8° | 120.0° |
O3 | C8 | O4 | 123.2° | 120.0° |
N3 | C8 | O4 | 125.0° | 120.0° |
C8 | N3 | H15 | 120.0° | 120.0° |
C8 | N3 | H16 | 120.0° | 120.0° |
C7 | C6 | C5 | 108.9° | 109.0° |
C7 | C6 | O2 | 111.6° | 109.5° |
C7 | C6 | H12 | 108.2° | 109.6° |
C6 | C7 | H14 | 110.5° | 109.5° |
C6 | C5 | N2 | 109.3° | 109.5° |
C5 | C6 | O2 | 110.5° | 109.6° |
C6 | C5 | H11 | 107.4° | 109.5° |
C5 | C6 | H12 | 108.1° | 109.5° |
C5 | N2 | C4 | 122.8° | 120.0° |
C5 | N2 | H10 | 118.6° | 120.0° |
N2 | C5 | H11 | 108.4° | 109.5° |
O2 | C6 | H12 | 109.5° | 109.6° |
C6 | O2 | H13 | 109.5° | 114.0° |
N2 | C4 | O1 | 121.6° | 120.1° |
N2 | C4 | C3 | 114.8° | 119.9° |
C4 | N2 | H10 | 118.6° | 120.0° |
O1 | C4 | C3 | 123.5° | 120.0° |
C4 | C3 | C2 | 114.0° | 109.4° |
C4 | C3 | H8 | 108.3° | 109.5° |
C4 | C3 | H9 | 108.3° | 109.5° |
N1 | C1 | C2 | 114.1° | 109.5° |
C1 | N1 | H1 | 109.5° | 111.0° |
C1 | N1 | H2 | 109.5° | 111.0° |
N1 | C1 | H4 | 108.3° | 109.5° |
N1 | C1 | H5 | 108.3° | 109.4° |
C1 | C2 | C3 | 114.1° | 109.5° |
C2 | C1 | H4 | 108.3° | 109.5° |
C2 | C1 | H5 | 108.3° | 109.5° |
C1 | C2 | H6 | 108.3° | 109.5° |
C1 | C2 | H7 | 108.3° | 109.4° |
C3 | C2 | H6 | 108.3° | 109.5° |
C3 | C2 | H7 | 108.3° | 109.5° |
C2 | C3 | H8 | 108.4° | 109.4° |
C2 | C3 | H9 | 108.3° | 109.5° |
H1 | N1 | H2 | 109.5° | 111.1° |
H4 | C1 | H5 | 109.5° | 109.4° |
H6 | C2 | H7 | 109.4° | 109.4° |
H8 | C3 | H9 | 109.4° | 109.5° |
H15 | N3 | H16 | 120.0° | 120.0° |
H18 | C10 | H19 | 109.5° | 109.4° |
H25 | C15 | H26 | 109.4° | 108.2° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O7 | C14 | N6 | C13 | 178.3° | 179.9° |
O7 | C14 | N6 | C15 | 168.1° | 171.5° |
O7 | C14 | C13 | N5 | 39.5° | 25.7° |
O7 | C14 | C13 | C17 | 152.5° | 134.8° |
O7 | C14 | C13 | H23 | 88.2° | 104.8° |
O7 | C14 | N6 | H24 | 11.9° | 8.7° |
C14 | N6 | C15 | H24 | 180.0° | 179.8° |
C14 | N6 | C15 | C16 | 14.6° | 35.4° |
N6 | C14 | C13 | N5 | 138.8° | 154.3° |
N6 | C14 | C13 | C17 | 25.9° | 45.2° |
N6 | C14 | C13 | H23 | 93.4° | 75.1° |
C14 | N6 | C15 | H25 | 135.0° | 156.8° |
C14 | N6 | C15 | H26 | 105.8° | 86.0° |
C15 | N6 | C14 | C13 | 13.6° | 8.5° |
N6 | C15 | C16 | H25 | 120.4° | 121.4° |
N6 | C15 | C16 | H26 | 120.4° | 121.4° |
N6 | C15 | C16 | C17 | 24.3° | 1.7° |
N6 | C15 | C16 | O8 | 96.6° | 121.6° |
N6 | C15 | H25 | H26 | 118.8° | 117.3° |
N6 | C15 | C16 | H27 | 143.5° | 118.3° |
C14 | C13 | N5 | C17 | 118.8° | 110.9° |
C14 | C13 | N5 | H23 | 127.5° | 130.8° |
C14 | C13 | C17 | H23 | 119.6° | 120.5° |
C14 | C13 | N5 | C12 | 147.9° | 147.4° |
C14 | C13 | C17 | C16 | 61.6° | 76.6° |
C14 | C13 | C17 | N7 | 170.5° | 156.9° |
C14 | C13 | N5 | H22 | 32.1° | 32.6° |
C13 | C14 | N6 | H24 | 166.4° | 171.4° |
C14 | C13 | C17 | H29 | 56.3° | 41.5° |
C15 | C16 | C17 | C13 | 60.7° | 50.8° |
C15 | C16 | C17 | O8 | 121.3° | 119.9° |
C15 | C16 | C17 | H27 | 119.1° | 120.0° |
C15 | C16 | C17 | N7 | 172.0° | 165.9° |
C15 | C16 | O8 | H27 | 119.0° | 120.1° |
C16 | C15 | N6 | H24 | 165.4° | 144.4° |
C16 | C15 | H25 | H26 | 118.8° | 117.4° |
C15 | C16 | O8 | H28 | 180.0° | 60.0° |
C15 | C16 | C17 | H29 | 57.2° | 67.2° |
O5 | C10 | C9 | H18 | 119.1° | 120.0° |
O5 | C10 | C9 | H19 | 119.1° | 120.0° |
O5 | C10 | C9 | O6 | 63.0° | 65.0° |
O5 | C10 | C9 | C7 | 175.8° | 175.0° |
O5 | C10 | C9 | H17 | 54.7° | 55.0° |
O5 | C10 | H18 | H19 | 122.6° | 120.0° |
N5 | C13 | C17 | H23 | 114.5° | 118.0° |
C13 | N5 | C12 | H22 | 180.0° | 179.9° |
N5 | C13 | C17 | C16 | 172.4° | 161.9° |
N5 | C13 | C17 | N7 | 44.5° | 35.4° |
C13 | N5 | C12 | N4 | 179.7° | 154.5° |
C13 | N5 | C12 | N7 | 0.9° | 25.3° |
N5 | C13 | C17 | H29 | 69.6° | 79.9° |
C17 | C13 | N5 | C12 | 29.1° | 36.5° |
C13 | C17 | C16 | N7 | 111.3° | 115.1° |
C13 | C17 | C16 | H29 | 117.9° | 118.0° |
C13 | C17 | N7 | H29 | 113.3° | 115.4° |
C13 | C17 | C16 | O8 | 60.6° | 69.1° |
C13 | C17 | N7 | C12 | 46.1° | 21.8° |
C17 | C13 | N5 | H22 | 150.9° | 143.5° |
C13 | C17 | C16 | H27 | 179.8° | 170.8° |
C13 | C17 | N7 | H30 | 133.8° | 158.3° |
N5 | C12 | N7 | C17 | 30.0° | 1.0° |
N5 | C12 | N4 | N7 | 178.6° | 179.7° |
N5 | C12 | N4 | C11 | 176.7° | 179.7° |
C12 | N5 | C13 | H23 | 84.6° | 81.8° |
N5 | C12 | N7 | H30 | 149.9° | 178.9° |
C16 | C17 | N7 | H29 | 130.4° | 127.0° |
C17 | C16 | O8 | H27 | 118.9° | 120.0° |
C16 | C17 | N7 | C12 | 162.4° | 139.4° |
C16 | C17 | C13 | H23 | 57.9° | 43.9° |
C17 | C16 | C15 | H25 | 96.1° | 123.1° |
C17 | C16 | C15 | H26 | 144.7° | 119.7° |
C17 | C16 | O8 | H28 | 57.9° | 179.9° |
C16 | C17 | N7 | H30 | 17.6° | 40.7° |
N7 | C17 | C16 | O8 | 50.8° | 46.0° |
C17 | N7 | C12 | N4 | 148.7° | 178.8° |
C17 | N7 | C12 | H30 | 180.0° | 179.9° |
N7 | C17 | C13 | H23 | 70.0° | 82.6° |
N7 | C17 | C16 | H27 | 68.9° | 74.0° |
O8 | C16 | C15 | H25 | 143.0° | 117.0° |
O8 | C16 | C15 | H26 | 23.8° | 0.2° |
O8 | C16 | C17 | H29 | 178.4° | 172.8° |
C10 | C9 | O6 | C7 | 123.4° | 120.0° |
C10 | C9 | O6 | H17 | 117.2° | 120.0° |
C10 | C9 | O6 | C11 | 174.2° | 178.9° |
C10 | C9 | C7 | H17 | 121.3° | 120.0° |
C10 | C9 | C7 | O3 | 58.7° | 57.7° |
C10 | C9 | C7 | C6 | 175.2° | 177.6° |
C10 | C9 | C7 | H14 | 63.4° | 62.5° |
C9 | C10 | H18 | H19 | 122.6° | 120.0° |
C9 | C10 | O5 | H20 | 180.0° | 180.0° |
C12 | N4 | C11 | O6 | 125.3° | 119.9° |
C12 | N4 | C11 | C5 | 117.9° | 120.0° |
C12 | N4 | C11 | H21 | 3.2° | 0.0° |
N4 | C12 | N5 | H22 | 0.3° | 25.6° |
N4 | C12 | N7 | H30 | 31.3° | 1.4° |
N7 | C12 | N4 | C11 | 4.7° | 0.0° |
N7 | C12 | N5 | H22 | 179.1° | 154.7° |
C12 | N7 | C17 | H29 | 67.1° | 93.6° |
C9 | O6 | C11 | N4 | 178.8° | 178.8° |
O6 | C9 | C7 | H17 | 120.1° | 120.0° |
C9 | O6 | C11 | C5 | 61.4° | 61.1° |
O6 | C9 | C7 | O3 | 60.0° | 62.3° |
O6 | C9 | C7 | C6 | 56.6° | 57.6° |
O6 | C9 | C7 | H14 | 177.9° | 177.5° |
O6 | C9 | C10 | H18 | 56.1° | 175.0° |
O6 | C9 | C10 | H19 | 177.9° | 55.0° |
C9 | O6 | C11 | H21 | 59.2° | 58.9° |
O6 | C11 | N4 | C5 | 116.9° | 120.1° |
O6 | C11 | N4 | H21 | 122.1° | 120.0° |
C11 | O6 | C9 | C7 | 62.4° | 61.1° |
O6 | C11 | C5 | H21 | 121.2° | 120.0° |
O6 | C11 | C5 | C6 | 57.8° | 57.6° |
O6 | C11 | C5 | N2 | 179.2° | 177.5° |
O6 | C11 | C5 | H11 | 60.3° | 62.3° |
C11 | O6 | C9 | H17 | 57.0° | 58.9° |
N4 | C11 | C5 | H21 | 121.4° | 119.9° |
N4 | C11 | C5 | C6 | 175.2° | 177.7° |
N4 | C11 | C5 | N2 | 61.8° | 62.4° |
N4 | C11 | C5 | H11 | 57.1° | 57.7° |
C9 | C7 | O3 | C6 | 117.0° | 119.7° |
C9 | C7 | O3 | H14 | 121.5° | 120.2° |
C9 | C7 | O3 | C8 | 168.5° | 90.3° |
C9 | C7 | C6 | H14 | 121.3° | 119.9° |
C9 | C7 | C6 | C5 | 53.6° | 57.0° |
C9 | C7 | C6 | O2 | 68.6° | 62.9° |
C9 | C7 | C6 | H12 | 170.9° | 176.8° |
C7 | C9 | C10 | H18 | 65.1° | 55.0° |
C7 | C9 | C10 | H19 | 56.7° | 65.0° |
C11 | C5 | C6 | C7 | 56.2° | 57.0° |
C11 | C5 | C6 | N2 | 124.1° | 119.9° |
C11 | C5 | C6 | H11 | 118.5° | 119.9° |
C11 | C5 | N2 | H11 | 118.6° | 120.2° |
C11 | C5 | C6 | O2 | 66.7° | 62.9° |
C11 | C5 | N2 | C4 | 144.7° | 85.3° |
C11 | C5 | N2 | H10 | 35.3° | 94.7° |
C11 | C5 | C6 | H12 | 173.6° | 176.9° |
C7 | O3 | C8 | N3 | 167.2° | 180.0° |
O3 | C7 | C6 | H14 | 122.1° | 120.1° |
O3 | C7 | C6 | C5 | 63.0° | 62.9° |
C7 | O3 | C8 | O4 | 11.8° | 0.0° |
O3 | C7 | C6 | O2 | 174.8° | 177.2° |
O3 | C7 | C6 | H12 | 54.3° | 56.9° |
O3 | C7 | C9 | H17 | 179.9° | 177.7° |
O3 | C8 | N3 | O4 | 179.0° | 180.0° |
C8 | O3 | C7 | C6 | 74.5° | 150.0° |
C8 | O3 | C7 | H14 | 47.0° | 29.9° |
O3 | C8 | N3 | H15 | 179.0° | 0.1° |
O3 | C8 | N3 | H16 | 1.0° | 180.0° |
C8 | N3 | H15 | H16 | 180.0° | 179.9° |
C7 | C6 | C5 | O2 | 122.9° | 119.9° |
C7 | C6 | C5 | H12 | 117.4° | 119.9° |
C7 | C6 | C5 | N2 | 179.7° | 176.9° |
C7 | C6 | O2 | H12 | 119.7° | 120.3° |
C7 | C6 | C5 | H11 | 62.3° | 62.9° |
C7 | C6 | O2 | H13 | 180.0° | 60.5° |
C6 | C7 | C9 | H17 | 63.5° | 62.4° |
C6 | C5 | N2 | H11 | 116.8° | 120.2° |
C5 | C6 | O2 | H12 | 118.9° | 120.2° |
C6 | C5 | N2 | C4 | 90.7° | 155.0° |
C6 | C5 | N2 | H10 | 89.2° | 25.0° |
C5 | C6 | O2 | H13 | 58.7° | 180.0° |
C5 | C6 | C7 | H14 | 174.9° | 176.9° |
C6 | C5 | C11 | H21 | 63.4° | 62.4° |
N2 | C5 | C6 | O2 | 57.4° | 57.0° |
C5 | N2 | C4 | H10 | 180.0° | 180.0° |
C5 | N2 | C4 | O1 | 1.1° | 0.0° |
C5 | N2 | C4 | C3 | 175.4° | 180.0° |
N2 | C5 | C6 | H12 | 62.4° | 63.2° |
N2 | C5 | C11 | H21 | 59.5° | 57.5° |
O4 | C8 | N3 | H15 | 0.0° | 180.0° |
O4 | C8 | N3 | H16 | 180.0° | 0.1° |
O2 | C6 | C5 | H11 | 174.8° | 177.2° |
O2 | C6 | C7 | H14 | 52.7° | 57.1° |
N2 | C4 | O1 | C3 | 176.1° | 180.0° |
N2 | C4 | C3 | C2 | 177.6° | 180.0° |
N2 | C4 | C3 | H8 | 56.9° | 60.1° |
N2 | C4 | C3 | H9 | 61.7° | 60.0° |
C4 | N2 | C5 | H11 | 26.1° | 34.9° |
O1 | C4 | C3 | C2 | 6.0° | 0.0° |
O1 | C4 | C3 | H8 | 126.7° | 119.9° |
O1 | C4 | C3 | H9 | 114.7° | 120.0° |
O1 | C4 | N2 | H10 | 178.9° | 180.0° |
C4 | C3 | C2 | C1 | 71.9° | 180.0° |
C4 | C3 | C2 | H8 | 120.7° | 119.9° |
C4 | C3 | C2 | H9 | 120.7° | 120.0° |
C4 | C3 | C2 | H6 | 167.4° | 60.0° |
C4 | C3 | C2 | H7 | 48.8° | 60.0° |
C4 | C3 | H8 | H9 | 117.9° | 120.1° |
C3 | C4 | N2 | H10 | 4.7° | 0.1° |
N1 | C1 | C2 | H4 | 120.7° | 120.0° |
N1 | C1 | C2 | H5 | 120.7° | 120.0° |
N1 | C1 | C2 | C3 | 143.1° | 180.0° |
C1 | N1 | H1 | H2 | 120.0° | 124.0° |
N1 | C1 | H4 | H5 | 117.9° | 119.9° |
N1 | C1 | C2 | H6 | 96.2° | 59.9° |
N1 | C1 | C2 | H7 | 22.4° | 60.0° |
C1 | C2 | C3 | H6 | 120.7° | 120.0° |
C1 | C2 | C3 | H7 | 120.7° | 120.0° |
C2 | C1 | N1 | H1 | 180.0° | 56.0° |
C2 | C1 | N1 | H2 | 60.0° | 180.0° |
C2 | C1 | H4 | H5 | 117.9° | 120.0° |
C1 | C2 | H6 | H7 | 117.9° | 119.9° |
C1 | C2 | C3 | H8 | 167.4° | 60.0° |
C1 | C2 | C3 | H9 | 48.8° | 60.0° |
C3 | C2 | C1 | H4 | 22.4° | 60.0° |
C3 | C2 | C1 | H5 | 96.2° | 60.0° |
C3 | C2 | H6 | H7 | 117.9° | 120.1° |
C2 | C3 | H8 | H9 | 117.9° | 120.0° |
H1 | N1 | C1 | H4 | 59.3° | 176.1° |
H1 | N1 | C1 | H5 | 59.3° | 64.0° |
H2 | N1 | C1 | H4 | 60.7° | 59.9° |
H2 | N1 | C1 | H5 | 179.3° | 60.0° |
H4 | C1 | C2 | H6 | 143.1° | 180.0° |
H4 | C1 | C2 | H7 | 98.3° | 60.1° |
H5 | C1 | C2 | H6 | 24.5° | 60.0° |
H5 | C1 | C2 | H7 | 143.1° | 180.0° |
H6 | C2 | C3 | H8 | 46.7° | 180.0° |
H6 | C2 | C3 | H9 | 71.9° | 60.0° |
H7 | C2 | C3 | H8 | 71.9° | 60.0° |
H7 | C2 | C3 | H9 | 169.5° | 180.0° |
H10 | N2 | C5 | H11 | 154.0° | 145.1° |
H11 | C5 | C6 | H12 | 55.1° | 57.0° |
H11 | C5 | C11 | H21 | 178.5° | 177.7° |
H12 | C6 | O2 | H13 | 60.3° | 59.8° |
H12 | C6 | C7 | H14 | 67.8° | 63.2° |
H14 | C7 | C9 | H17 | 57.9° | 57.5° |
H17 | C9 | C10 | H18 | 173.8° | 65.1° |
H17 | C9 | C10 | H19 | 64.4° | 175.0° |
H18 | C10 | O5 | H20 | 60.9° | 59.9° |
H19 | C10 | O5 | H20 | 60.9° | 60.0° |
H22 | N5 | C13 | H23 | 95.4° | 98.2° |
H23 | C13 | C17 | H29 | 175.9° | 162.1° |
H24 | N6 | C15 | H25 | 45.0° | 23.0° |
H24 | N6 | C15 | H26 | 74.2° | 94.2° |
H25 | C15 | C16 | H27 | 23.1° | 3.1° |
H26 | C15 | C16 | H27 | 96.0° | 120.3° |
H27 | C16 | O8 | H28 | 61.0° | 60.0° |
H27 | C16 | C17 | H29 | 61.9° | 52.8° |
H29 | C17 | N7 | H30 | 112.9° | 86.2° |