528
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C37 | C36 | doub | 1.38Å | 1.42Å | Aromatic |
| C37 | C38 | sing | 1.38Å | 1.42Å | Aromatic |
| C37 | H37 | sing | 1.08Å | 1.08Å | |
| C38 | C41 | doub | 1.38Å | 1.42Å | Aromatic |
| C38 | H38 | sing | 1.08Å | 1.08Å | |
| C41 | C40 | sing | 1.38Å | 1.42Å | Aromatic |
| C41 | H41 | sing | 1.08Å | 1.08Å | |
| C40 | C39 | doub | 1.38Å | 1.42Å | Aromatic |
| C40 | H40 | sing | 1.08Å | 1.08Å | |
| C39 | C36 | sing | 1.38Å | 1.42Å | Aromatic |
| C39 | H39 | sing | 1.08Å | 1.08Å | |
| C36 | C35 | sing | 1.51Å | 1.55Å | |
| C35 | C34 | sing | 1.53Å | 1.54Å | |
| C35 | H351 | sing | 1.09Å | 1.10Å | |
| C35 | H352 | sing | 1.09Å | 1.10Å | |
| C34 | C33 | sing | 1.53Å | 1.53Å | |
| C34 | H341 | sing | 1.09Å | 1.10Å | |
| C34 | H342 | sing | 1.09Å | 1.10Å | |
| C33 | S32 | sing | 1.81Å | 1.82Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| S32 | N31 | sing | 1.66Å | 1.65Å | |
| S32 | O32 | doub | 1.42Å | 1.51Å | |
| S32 | O33 | doub | 1.42Å | 1.50Å | |
| N31 | C27 | sing | 1.46Å | 1.44Å | |
| N31 | HN31 | sing | 0.97Å | 1.00Å | |
| C27 | C28 | sing | 1.53Å | 1.55Å | |
| C27 | P24 | sing | 1.82Å | 1.85Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C28 | C30 | sing | 1.53Å | 1.53Å | |
| C28 | C29 | sing | 1.53Å | 1.53Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C30 | H301 | sing | 1.09Å | 1.10Å | |
| C30 | H302 | sing | 1.09Å | 1.10Å | |
| C30 | H303 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C29 | H292 | sing | 1.09Å | 1.10Å | |
| C29 | H293 | sing | 1.09Å | 1.10Å | |
| P24 | O25 | doub | 1.48Å | 1.48Å | |
| P24 | C15 | sing | 1.82Å | 1.83Å | |
| P24 | O26 | sing | 1.61Å | 1.48Å | |
| O26 | HO26 | sing | 0.97Å | 0.95Å | |
| C15 | C1 | sing | 1.53Å | 1.55Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C1 | C3 | sing | 1.51Å | 1.55Å | |
| C1 | C2 | sing | 1.51Å | 1.55Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | O14 | doub | 1.21Å | 1.25Å | |
| C2 | O13 | sing | 1.34Å | 1.26Å | |
| O13 | HO13 | sing | 0.97Å | 0.95Å | |
| C3 | C8 | doub | 1.38Å | 1.41Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.43Å | Aromatic |
| C8 | C7 | sing | 1.38Å | 1.41Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C4 | C5 | doub | 1.38Å | 1.42Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | C6 | sing | 1.38Å | 1.41Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | C7 | doub | 1.38Å | 1.42Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | C9 | sing | 1.51Å | 1.52Å | |
| C9 | N10 | sing | 1.47Å | 1.47Å | |
| C9 | H91 | sing | 1.09Å | 1.10Å | |
| C9 | H92 | sing | 1.09Å | 1.10Å | |
| N10 | H101 | sing | 1.01Å | 1.00Å | |
| N10 | H102 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C36 | C37 | C38 | 120.1° | 120.1° |
| C36 | C37 | H37 | 119.9° | 119.9° |
| C37 | C36 | C39 | 119.7° | 120.0° |
| C37 | C36 | C35 | 120.2° | 120.1° |
| C38 | C37 | H37 | 120.0° | 120.0° |
| C37 | C38 | C41 | 120.0° | 120.0° |
| C37 | C38 | H38 | 120.0° | 120.1° |
| C41 | C38 | H38 | 120.0° | 120.0° |
| C38 | C41 | C40 | 120.1° | 120.0° |
| C38 | C41 | H41 | 120.0° | 120.0° |
| C40 | C41 | H41 | 120.0° | 120.0° |
| C41 | C40 | C39 | 120.1° | 120.0° |
| C41 | C40 | H40 | 120.0° | 120.1° |
| C39 | C40 | H40 | 120.0° | 120.0° |
| C40 | C39 | C36 | 120.1° | 120.0° |
| C40 | C39 | H39 | 120.0° | 120.0° |
| C36 | C39 | H39 | 120.0° | 120.0° |
| C39 | C36 | C35 | 120.1° | 120.0° |
| C36 | C35 | C34 | 112.8° | 109.5° |
| C36 | C35 | H351 | 108.4° | 109.5° |
| C36 | C35 | H352 | 107.6° | 109.5° |
| C34 | C35 | H351 | 108.4° | 109.5° |
| C34 | C35 | H352 | 107.6° | 109.5° |
| C35 | C34 | C33 | 112.1° | 109.5° |
| C35 | C34 | H341 | 108.6° | 109.5° |
| C35 | C34 | H342 | 108.0° | 109.5° |
| H351 | C35 | H352 | 112.1° | 109.5° |
| C33 | C34 | H341 | 108.6° | 109.4° |
| C33 | C34 | H342 | 108.0° | 109.4° |
| C34 | C33 | S32 | 112.9° | 109.5° |
| C34 | C33 | H331 | 108.4° | 109.5° |
| C34 | C33 | H332 | 107.6° | 109.4° |
| H341 | C34 | H342 | 111.5° | 109.5° |
| S32 | C33 | H331 | 108.3° | 109.5° |
| S32 | C33 | H332 | 107.6° | 109.5° |
| C33 | S32 | N31 | 109.3° | 104.4° |
| C33 | S32 | O32 | 109.7° | 110.6° |
| C33 | S32 | O33 | 109.1° | 110.6° |
| H331 | C33 | H332 | 112.2° | 109.5° |
| N31 | S32 | O32 | 110.1° | 104.2° |
| N31 | S32 | O33 | 109.3° | 104.3° |
| S32 | N31 | C27 | 123.4° | 120.0° |
| S32 | N31 | HN31 | 105.1° | 120.0° |
| O32 | S32 | O33 | 109.3° | 121.0° |
| C27 | N31 | HN31 | 105.1° | 120.0° |
| N31 | C27 | C28 | 111.7° | 109.5° |
| N31 | C27 | P24 | 111.8° | 109.5° |
| N31 | C27 | H27 | 108.7° | 109.5° |
| C28 | C27 | P24 | 115.7° | 109.5° |
| C28 | C27 | H27 | 104.1° | 109.5° |
| C27 | C28 | C30 | 113.7° | 109.5° |
| C27 | C28 | C29 | 109.8° | 109.5° |
| C27 | C28 | H28 | 106.3° | 109.5° |
| P24 | C27 | H27 | 104.0° | 109.5° |
| C27 | P24 | O25 | 108.6° | 109.5° |
| C27 | P24 | C15 | 107.3° | 109.5° |
| C27 | P24 | O26 | 105.3° | 109.5° |
| C30 | C28 | C29 | 109.3° | 109.4° |
| C30 | C28 | H28 | 106.8° | 109.4° |
| C28 | C30 | H301 | 109.5° | 109.5° |
| C28 | C30 | H302 | 109.5° | 109.5° |
| C28 | C30 | H303 | 109.5° | 109.5° |
| C29 | C28 | H28 | 111.0° | 109.5° |
| C28 | C29 | H291 | 109.5° | 109.4° |
| C28 | C29 | H292 | 109.5° | 109.5° |
| C28 | C29 | H293 | 109.4° | 109.5° |
| H301 | C30 | H302 | 109.5° | 109.5° |
| H301 | C30 | H303 | 109.4° | 109.5° |
| H302 | C30 | H303 | 109.5° | 109.5° |
| H291 | C29 | H292 | 109.5° | 109.4° |
| H291 | C29 | H293 | 109.5° | 109.5° |
| H292 | C29 | H293 | 109.5° | 109.5° |
| O25 | P24 | C15 | 108.6° | 109.5° |
| O25 | P24 | O26 | 117.9° | 109.5° |
| C15 | P24 | O26 | 108.7° | 109.4° |
| P24 | C15 | C1 | 110.3° | 109.5° |
| P24 | C15 | H151 | 109.2° | 109.4° |
| P24 | C15 | H152 | 109.0° | 109.5° |
| P24 | O26 | HO26 | 109.5° | 114.0° |
| C1 | C15 | H151 | 109.2° | 109.5° |
| C1 | C15 | H152 | 109.0° | 109.5° |
| C15 | C1 | C3 | 111.5° | 109.5° |
| C15 | C1 | C2 | 111.8° | 109.5° |
| C15 | C1 | H1 | 106.1° | 109.5° |
| H151 | C15 | H152 | 110.1° | 109.5° |
| C3 | C1 | C2 | 108.4° | 109.5° |
| C3 | C1 | H1 | 109.6° | 109.5° |
| C1 | C3 | C8 | 118.8° | 120.0° |
| C1 | C3 | C4 | 121.5° | 119.9° |
| C2 | C1 | H1 | 109.3° | 109.4° |
| C1 | C2 | O14 | 116.8° | 120.0° |
| C1 | C2 | O13 | 117.5° | 120.0° |
| O14 | C2 | O13 | 125.7° | 120.0° |
| C2 | O13 | HO13 | 109.5° | 117.0° |
| C8 | C3 | C4 | 119.5° | 120.0° |
| C3 | C8 | C7 | 120.2° | 120.0° |
| C3 | C8 | H8 | 119.9° | 120.0° |
| C3 | C4 | C5 | 120.1° | 119.9° |
| C3 | C4 | H4 | 119.9° | 120.1° |
| C7 | C8 | H8 | 119.9° | 120.0° |
| C8 | C7 | C6 | 120.2° | 120.1° |
| C8 | C7 | C9 | 119.7° | 120.0° |
| C5 | C4 | H4 | 119.9° | 120.0° |
| C4 | C5 | C6 | 120.0° | 120.0° |
| C4 | C5 | H5 | 120.0° | 120.0° |
| C6 | C5 | H5 | 120.0° | 120.0° |
| C5 | C6 | C7 | 119.9° | 120.0° |
| C5 | C6 | H6 | 120.1° | 120.0° |
| C7 | C6 | H6 | 120.0° | 120.0° |
| C6 | C7 | C9 | 120.1° | 120.0° |
| C7 | C9 | N10 | 109.0° | 109.5° |
| C7 | C9 | H91 | 109.6° | 109.5° |
| C7 | C9 | H92 | 109.7° | 109.5° |
| N10 | C9 | H91 | 109.6° | 109.4° |
| N10 | C9 | H92 | 109.8° | 109.5° |
| C9 | N10 | H101 | 109.5° | 111.0° |
| C9 | N10 | H102 | 109.5° | 110.9° |
| H91 | C9 | H92 | 109.1° | 109.5° |
| H101 | N10 | H102 | 109.4° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C36 | C37 | C38 | H37 | 180.0° | 179.7° |
| C36 | C37 | C38 | C41 | 0.0° | 0.0° |
| C36 | C37 | C38 | H38 | 180.0° | 180.0° |
| C37 | C36 | C39 | C40 | 0.0° | 0.1° |
| C37 | C36 | C39 | C35 | 179.5° | 180.0° |
| C37 | C36 | C39 | H39 | 180.0° | 180.0° |
| C37 | C36 | C35 | C34 | 71.2° | 90.0° |
| C37 | C36 | C35 | H351 | 168.8° | 150.0° |
| C37 | C36 | C35 | H352 | 47.4° | 30.0° |
| C37 | C38 | C41 | H38 | 180.0° | 180.0° |
| C37 | C38 | C41 | C40 | 0.0° | 0.0° |
| C37 | C38 | C41 | H41 | 180.0° | 180.0° |
| C38 | C37 | C36 | C39 | 0.0° | 0.0° |
| C38 | C37 | C36 | C35 | 179.5° | 180.0° |
| H37 | C37 | C38 | C41 | 180.0° | 179.7° |
| H37 | C37 | C38 | H38 | 0.0° | 0.3° |
| H37 | C37 | C36 | C39 | 180.0° | 179.7° |
| H37 | C37 | C36 | C35 | 0.5° | 0.3° |
| C38 | C41 | C40 | H41 | 180.0° | 180.0° |
| C38 | C41 | C40 | C39 | 0.0° | 0.0° |
| C38 | C41 | C40 | H40 | 179.9° | 180.0° |
| H38 | C38 | C41 | C40 | 180.0° | 180.0° |
| H38 | C38 | C41 | H41 | 0.0° | 0.0° |
| C41 | C40 | C39 | H40 | 180.0° | 180.0° |
| C41 | C40 | C39 | C36 | 0.0° | 0.1° |
| C41 | C40 | C39 | H39 | 179.9° | 180.0° |
| H41 | C41 | C40 | C39 | 180.0° | 179.9° |
| H41 | C41 | C40 | H40 | 0.1° | 0.1° |
| C40 | C39 | C36 | H39 | 180.0° | 179.9° |
| C40 | C39 | C36 | C35 | 179.5° | 179.9° |
| H40 | C40 | C39 | C36 | 179.9° | 179.9° |
| H40 | C40 | C39 | H39 | 0.1° | 0.0° |
| C39 | C36 | C35 | C34 | 109.3° | 90.1° |
| C39 | C36 | C35 | H351 | 10.7° | 29.9° |
| C39 | C36 | C35 | H352 | 132.1° | 149.9° |
| H39 | C39 | C36 | C35 | 0.5° | 0.0° |
| C36 | C35 | C34 | H351 | 120.0° | 120.0° |
| C36 | C35 | C34 | H352 | 118.6° | 120.0° |
| C36 | C35 | H351 | H352 | 118.7° | 120.0° |
| C36 | C35 | C34 | C33 | 70.4° | 180.0° |
| C36 | C35 | C34 | H341 | 169.6° | 60.0° |
| C36 | C35 | C34 | H342 | 48.5° | 60.0° |
| C34 | C35 | H351 | H352 | 118.6° | 120.0° |
| C35 | C34 | C33 | H341 | 120.0° | 120.0° |
| C35 | C34 | C33 | H342 | 118.9° | 120.0° |
| C35 | C34 | H341 | H342 | 118.9° | 120.1° |
| C35 | C34 | C33 | S32 | 169.6° | 180.0° |
| C35 | C34 | C33 | H331 | 49.6° | 59.9° |
| C35 | C34 | C33 | H332 | 71.9° | 60.0° |
| H351 | C35 | C34 | C33 | 49.6° | 60.0° |
| H351 | C35 | C34 | H341 | 70.4° | 179.9° |
| H351 | C35 | C34 | H342 | 168.5° | 60.0° |
| H352 | C35 | C34 | C33 | 171.1° | 60.0° |
| H352 | C35 | C34 | H341 | 51.0° | 60.0° |
| H352 | C35 | C34 | H342 | 70.1° | 180.0° |
| C33 | C34 | H341 | H342 | 118.9° | 119.9° |
| C34 | C33 | S32 | H331 | 120.0° | 120.0° |
| C34 | C33 | S32 | H332 | 118.5° | 120.0° |
| C34 | C33 | H331 | H332 | 118.6° | 120.0° |
| C34 | C33 | S32 | N31 | 178.4° | 180.0° |
| C34 | C33 | S32 | O32 | 57.6° | 68.4° |
| C34 | C33 | S32 | O33 | 62.2° | 68.4° |
| H341 | C34 | C33 | S32 | 70.4° | 60.0° |
| H341 | C34 | C33 | H331 | 169.6° | 180.0° |
| H341 | C34 | C33 | H332 | 48.1° | 60.0° |
| H342 | C34 | C33 | S32 | 50.7° | 60.0° |
| H342 | C34 | C33 | H331 | 69.3° | 60.1° |
| H342 | C34 | C33 | H332 | 169.2° | 180.0° |
| S32 | C33 | H331 | H332 | 118.6° | 120.0° |
| C33 | S32 | N31 | O32 | 120.5° | 116.1° |
| C33 | S32 | N31 | O33 | 119.3° | 116.1° |
| C33 | S32 | O32 | O33 | 119.6° | 131.6° |
| C33 | S32 | N31 | C27 | 122.5° | 66.6° |
| C33 | S32 | N31 | HN31 | 117.5° | 113.4° |
| H331 | C33 | S32 | N31 | 61.6° | 60.0° |
| H331 | C33 | S32 | O32 | 177.6° | 171.6° |
| H331 | C33 | S32 | O33 | 57.8° | 51.6° |
| H332 | C33 | S32 | N31 | 59.9° | 60.0° |
| H332 | C33 | S32 | O32 | 61.0° | 51.6° |
| H332 | C33 | S32 | O33 | 179.3° | 171.6° |
| N31 | S32 | O32 | O33 | 120.1° | 116.7° |
| S32 | N31 | C27 | HN31 | 120.0° | 180.0° |
| S32 | N31 | C27 | C28 | 122.6° | 112.1° |
| S32 | N31 | C27 | P24 | 106.0° | 127.9° |
| S32 | N31 | C27 | H27 | 8.2° | 7.9° |
| O32 | S32 | N31 | C27 | 1.9° | 49.5° |
| O32 | S32 | N31 | HN31 | 121.9° | 130.5° |
| O33 | S32 | N31 | C27 | 118.2° | 177.3° |
| O33 | S32 | N31 | HN31 | 1.8° | 2.7° |
| N31 | C27 | C28 | P24 | 129.5° | 120.0° |
| N31 | C27 | C28 | H27 | 117.1° | 120.0° |
| N31 | C27 | P24 | H27 | 117.1° | 120.0° |
| N31 | C27 | C28 | C30 | 57.9° | 174.5° |
| N31 | C27 | C28 | C29 | 64.8° | 54.5° |
| N31 | C27 | C28 | H28 | 175.1° | 65.6° |
| N31 | C27 | P24 | O25 | 171.2° | 45.5° |
| N31 | C27 | P24 | C15 | 54.0° | 165.5° |
| N31 | C27 | P24 | O26 | 61.7° | 74.5° |
| HN31 | N31 | C27 | C28 | 2.5° | 67.9° |
| HN31 | N31 | C27 | P24 | 134.0° | 52.1° |
| HN31 | N31 | C27 | H27 | 111.8° | 172.1° |
| C28 | C27 | P24 | H27 | 113.5° | 120.0° |
| C27 | C28 | C30 | C29 | 123.0° | 120.0° |
| C27 | C28 | C30 | H28 | 116.9° | 120.0° |
| C27 | C28 | C29 | H28 | 117.2° | 120.1° |
| C27 | C28 | C30 | H301 | 132.5° | 51.5° |
| C27 | C28 | C30 | H302 | 107.5° | 171.5° |
| C27 | C28 | C30 | H303 | 12.5° | 68.5° |
| C27 | C28 | C29 | H291 | 0.0° | 60.6° |
| C27 | C28 | C29 | H292 | 120.0° | 179.4° |
| C27 | C28 | C29 | H293 | 120.0° | 59.4° |
| C28 | C27 | P24 | O25 | 41.8° | 165.5° |
| C28 | C27 | P24 | C15 | 75.4° | 74.5° |
| C28 | C27 | P24 | O26 | 168.9° | 45.5° |
| P24 | C27 | C28 | C30 | 71.5° | 65.5° |
| P24 | C27 | C28 | C29 | 165.8° | 174.5° |
| P24 | C27 | C28 | H28 | 45.7° | 54.4° |
| C27 | P24 | O25 | C15 | 116.4° | 120.1° |
| C27 | P24 | O25 | O26 | 119.5° | 120.0° |
| C27 | P24 | C15 | O26 | 113.4° | 120.0° |
| C27 | P24 | O26 | HO26 | 169.9° | 54.2° |
| C27 | P24 | C15 | C1 | 165.6° | 170.1° |
| C27 | P24 | C15 | H151 | 74.4° | 50.0° |
| C27 | P24 | C15 | H152 | 45.9° | 69.9° |
| H27 | C27 | C28 | C30 | 175.1° | 54.5° |
| H27 | C27 | C28 | C29 | 52.3° | 65.5° |
| H27 | C27 | C28 | H28 | 67.7° | 174.4° |
| H27 | C27 | P24 | O25 | 71.7° | 74.5° |
| H27 | C27 | P24 | C15 | 171.1° | 45.5° |
| H27 | C27 | P24 | O26 | 55.4° | 165.5° |
| C30 | C28 | C29 | H28 | 117.5° | 119.9° |
| C28 | C30 | H301 | H302 | 120.0° | 120.1° |
| C28 | C30 | H301 | H303 | 120.0° | 120.0° |
| C28 | C30 | H302 | H303 | 120.0° | 120.0° |
| C30 | C28 | C29 | H291 | 125.3° | 179.4° |
| C30 | C28 | C29 | H292 | 5.3° | 59.4° |
| C30 | C28 | C29 | H293 | 114.7° | 60.6° |
| C29 | C28 | C30 | H301 | 104.5° | 68.5° |
| C29 | C28 | C30 | H302 | 15.5° | 51.5° |
| C29 | C28 | C30 | H303 | 135.5° | 171.5° |
| C28 | C29 | H291 | H292 | 120.0° | 120.0° |
| C28 | C29 | H291 | H293 | 120.0° | 120.0° |
| C28 | C29 | H292 | H293 | 120.0° | 120.0° |
| H28 | C28 | C30 | H301 | 15.6° | 171.5° |
| H28 | C28 | C30 | H302 | 135.6° | 68.5° |
| H28 | C28 | C30 | H303 | 104.4° | 51.5° |
| H28 | C28 | C29 | H291 | 117.2° | 59.4° |
| H28 | C28 | C29 | H292 | 122.8° | 60.5° |
| H28 | C28 | C29 | H293 | 2.8° | 179.5° |
| H301 | C30 | H302 | H303 | 120.0° | 120.0° |
| H291 | C29 | H292 | H293 | 120.0° | 120.0° |
| O25 | P24 | C15 | O26 | 129.4° | 120.0° |
| O25 | P24 | O26 | HO26 | 48.6° | 174.2° |
| O25 | P24 | C15 | C1 | 77.2° | 50.0° |
| O25 | P24 | C15 | H151 | 42.8° | 70.0° |
| O25 | P24 | C15 | H152 | 163.1° | 170.1° |
| C15 | P24 | O26 | HO26 | 75.4° | 65.9° |
| P24 | C15 | C1 | H151 | 120.0° | 120.0° |
| P24 | C15 | C1 | H152 | 119.6° | 120.0° |
| P24 | C15 | H151 | H152 | 119.6° | 120.0° |
| P24 | C15 | C1 | C3 | 165.6° | 165.0° |
| P24 | C15 | C1 | C2 | 72.8° | 75.0° |
| P24 | C15 | C1 | H1 | 46.3° | 44.9° |
| O26 | P24 | C15 | C1 | 52.1° | 69.9° |
| O26 | P24 | C15 | H151 | 172.2° | 170.1° |
| O26 | P24 | C15 | H152 | 67.5° | 50.1° |
| C1 | C15 | H151 | H152 | 119.7° | 120.0° |
| C15 | C1 | C3 | C2 | 123.5° | 120.0° |
| C15 | C1 | C3 | H1 | 117.2° | 120.0° |
| C15 | C1 | C2 | H1 | 117.2° | 120.0° |
| C15 | C1 | C2 | O14 | 143.7° | 0.0° |
| C15 | C1 | C2 | O13 | 36.7° | 180.0° |
| C15 | C1 | C3 | C8 | 129.3° | 120.0° |
| C15 | C1 | C3 | C4 | 55.2° | 59.7° |
| H151 | C15 | C1 | C3 | 45.6° | 45.0° |
| H151 | C15 | C1 | C2 | 167.2° | 165.0° |
| H151 | C15 | C1 | H1 | 73.7° | 75.1° |
| H152 | C15 | C1 | C3 | 74.8° | 75.0° |
| H152 | C15 | C1 | C2 | 46.8° | 45.0° |
| H152 | C15 | C1 | H1 | 165.9° | 164.9° |
| C3 | C1 | C2 | H1 | 119.5° | 120.0° |
| C3 | C1 | C2 | O14 | 93.0° | 120.0° |
| C3 | C1 | C2 | O13 | 86.6° | 60.0° |
| C1 | C3 | C8 | C4 | 175.6° | 179.7° |
| C1 | C3 | C8 | C7 | 175.0° | 180.0° |
| C1 | C3 | C8 | H8 | 5.1° | 0.0° |
| C1 | C3 | C4 | C5 | 174.9° | 180.0° |
| C1 | C3 | C4 | H4 | 5.1° | 0.0° |
| C1 | C2 | O14 | O13 | 179.6° | 180.0° |
| C1 | C2 | O13 | HO13 | 179.6° | 180.0° |
| C2 | C1 | C3 | C8 | 107.2° | 120.0° |
| C2 | C1 | C3 | C4 | 68.3° | 60.3° |
| H1 | C1 | C2 | O14 | 26.5° | 120.0° |
| H1 | C1 | C2 | O13 | 153.9° | 60.0° |
| H1 | C1 | C3 | C8 | 12.1° | 0.0° |
| H1 | C1 | C3 | C4 | 172.5° | 179.8° |
| O14 | C2 | O13 | HO13 | 0.0° | 0.0° |
| C3 | C8 | C7 | H8 | 180.0° | 180.0° |
| C8 | C3 | C4 | C5 | 0.6° | 0.3° |
| C8 | C3 | C4 | H4 | 179.4° | 179.7° |
| C3 | C8 | C7 | C6 | 0.3° | 0.0° |
| C3 | C8 | C7 | C9 | 178.7° | 180.0° |
| C4 | C3 | C8 | C7 | 0.6° | 0.3° |
| C4 | C3 | C8 | H8 | 179.4° | 179.7° |
| C3 | C4 | C5 | H4 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.2° | 0.1° |
| C3 | C4 | C5 | H5 | 179.8° | 180.0° |
| C8 | C7 | C6 | C5 | 0.0° | 0.2° |
| C8 | C7 | C6 | C9 | 179.0° | 180.0° |
| C8 | C7 | C6 | H6 | 179.9° | 180.0° |
| C8 | C7 | C9 | N10 | 79.7° | 90.0° |
| C8 | C7 | C9 | H91 | 40.3° | 150.0° |
| C8 | C7 | C9 | H92 | 160.1° | 30.1° |
| H8 | C8 | C7 | C6 | 179.7° | 180.0° |
| H8 | C8 | C7 | C9 | 1.3° | 0.0° |
| C4 | C5 | C6 | H5 | 180.0° | 179.9° |
| C4 | C5 | C6 | C7 | 0.1° | 0.2° |
| C4 | C5 | C6 | H6 | 179.9° | 180.0° |
| H4 | C4 | C5 | C6 | 179.8° | 180.0° |
| H4 | C4 | C5 | H5 | 0.2° | 0.1° |
| C5 | C6 | C7 | H6 | 180.0° | 179.8° |
| C5 | C6 | C7 | C9 | 179.1° | 179.7° |
| H5 | C5 | C6 | C7 | 179.9° | 179.7° |
| H5 | C5 | C6 | H6 | 0.1° | 0.1° |
| C6 | C7 | C9 | N10 | 99.3° | 90.0° |
| C6 | C7 | C9 | H91 | 140.7° | 30.0° |
| C6 | C7 | C9 | H92 | 20.9° | 150.0° |
| H6 | C6 | C7 | C9 | 0.9° | 0.0° |
| C7 | C9 | N10 | H91 | 120.0° | 120.0° |
| C7 | C9 | N10 | H92 | 120.2° | 120.1° |
| C7 | C9 | H91 | H92 | 120.2° | 120.0° |
| C7 | C9 | N10 | H101 | 179.0° | 180.0° |
| C7 | C9 | N10 | H102 | 59.0° | 56.0° |
| N10 | C9 | H91 | H92 | 120.2° | 120.0° |
| C9 | N10 | H101 | H102 | 120.0° | 123.9° |
| H91 | C9 | N10 | H101 | 61.0° | 60.0° |
| H91 | C9 | N10 | H102 | 179.0° | 176.0° |
| H92 | C9 | N10 | H101 | 58.8° | 59.9° |
| H92 | C9 | N10 | H102 | 61.2° | 64.0° |
