ZNZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O31 | P1 | doub | 1.48Å | 1.41Å | |
| O21 | P1 | sing | 1.61Å | 1.54Å | |
| P1 | O41 | sing | 1.61Å | 1.47Å | |
| P1 | O11 | sing | 1.61Å | 1.47Å | |
| O42 | P2 | doub | 1.48Å | 1.59Å | |
| O11 | C1 | sing | 1.43Å | 1.34Å | |
| O26 | P6 | doub | 1.48Å | 1.43Å | |
| P2 | O12 | sing | 1.61Å | 1.53Å | |
| P2 | O22 | sing | 1.61Å | 1.57Å | |
| P2 | O32 | sing | 1.61Å | 1.44Å | |
| O25 | P5 | doub | 1.48Å | 1.59Å | |
| O12 | C2 | sing | 1.43Å | 1.40Å | |
| C1 | C2 | sing | 1.53Å | 1.57Å | |
| C1 | C6 | sing | 1.53Å | 1.45Å | |
| O16 | P6 | sing | 1.61Å | 1.59Å | |
| O16 | C6 | sing | 1.43Å | 1.45Å | |
| P6 | O36 | sing | 1.61Å | 1.56Å | |
| P6 | O46 | sing | 1.61Å | 1.55Å | |
| C2 | C3 | sing | 1.53Å | 1.49Å | |
| C6 | C5 | sing | 1.53Å | 1.49Å | |
| O45 | P5 | sing | 1.61Å | 1.57Å | |
| P5 | O15 | sing | 1.61Å | 1.54Å | |
| P5 | O35 | sing | 1.61Å | 1.41Å | |
| O15 | C5 | sing | 1.43Å | 1.42Å | |
| C3 | O13 | sing | 1.43Å | 1.42Å | |
| C3 | C4 | sing | 1.53Å | 1.47Å | |
| C5 | C4 | sing | 1.53Å | 1.48Å | |
| O23 | P3 | doub | 1.48Å | 1.58Å | |
| O13 | P3 | sing | 1.61Å | 1.58Å | |
| C4 | O14 | sing | 1.43Å | 1.38Å | |
| O43 | P3 | sing | 1.61Å | 1.57Å | |
| P3 | O33 | sing | 1.61Å | 1.46Å | |
| O46 | H1 | sing | 0.97Å | 0.95Å | |
| O36 | H2 | sing | 0.97Å | 0.95Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H4 | sing | 1.09Å | 1.10Å | |
| O41 | H5 | sing | 0.97Å | 0.95Å | |
| O21 | H6 | sing | 0.97Å | 0.95Å | |
| C5 | H7 | sing | 1.09Å | 1.10Å | |
| O45 | H8 | sing | 0.97Å | 0.95Å | |
| O35 | H9 | sing | 0.97Å | 0.95Å | |
| C4 | H10 | sing | 1.09Å | 1.10Å | |
| O14 | H11 | sing | 0.97Å | 0.95Å | |
| C3 | H12 | sing | 1.09Å | 1.10Å | |
| O43 | H13 | sing | 0.97Å | 0.95Å | |
| O33 | H14 | sing | 0.97Å | 0.95Å | |
| C2 | H15 | sing | 1.09Å | 1.10Å | |
| O22 | H16 | sing | 0.97Å | 0.95Å | |
| O32 | H17 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O31 | P1 | O21 | 119.8° | 109.5° |
| O31 | P1 | O41 | 106.4° | 109.5° |
| O31 | P1 | O11 | 109.4° | 109.5° |
| O21 | P1 | O41 | 106.5° | 109.5° |
| O21 | P1 | O11 | 113.6° | 109.5° |
| P1 | O21 | H6 | 109.5° | 114.0° |
| O41 | P1 | O11 | 98.6° | 109.5° |
| P1 | O41 | H5 | 109.5° | 113.9° |
| P1 | O11 | C1 | 124.8° | 123.0° |
| O42 | P2 | O12 | 101.5° | 109.5° |
| O42 | P2 | O22 | 115.9° | 109.5° |
| O42 | P2 | O32 | 112.5° | 109.5° |
| O11 | C1 | C2 | 108.5° | 109.5° |
| O11 | C1 | C6 | 103.4° | 109.5° |
| O11 | C1 | H4 | 112.8° | 109.5° |
| O26 | P6 | O16 | 107.9° | 109.5° |
| O26 | P6 | O36 | 115.3° | 109.5° |
| O26 | P6 | O46 | 113.6° | 109.5° |
| O12 | P2 | O22 | 106.1° | 109.5° |
| O12 | P2 | O32 | 104.4° | 109.4° |
| P2 | O12 | C2 | 129.1° | 123.0° |
| O22 | P2 | O32 | 114.5° | 109.5° |
| P2 | O22 | H16 | 109.5° | 114.0° |
| P2 | O32 | H17 | 109.5° | 114.0° |
| O25 | P5 | O45 | 113.3° | 109.4° |
| O25 | P5 | O15 | 99.9° | 109.4° |
| O25 | P5 | O35 | 116.3° | 109.5° |
| O12 | C2 | C1 | 109.2° | 109.5° |
| O12 | C2 | C3 | 107.3° | 109.5° |
| O12 | C2 | H15 | 112.4° | 109.4° |
| C2 | C1 | C6 | 111.7° | 109.4° |
| C1 | C2 | C3 | 107.0° | 109.5° |
| C2 | C1 | H4 | 109.4° | 109.5° |
| C1 | C2 | H15 | 109.9° | 109.5° |
| C1 | C6 | O16 | 110.3° | 109.5° |
| C1 | C6 | C5 | 108.4° | 109.5° |
| C1 | C6 | H3 | 108.8° | 109.5° |
| C6 | C1 | H4 | 111.0° | 109.5° |
| P6 | O16 | C6 | 125.5° | 123.0° |
| O16 | P6 | O36 | 100.3° | 109.5° |
| O16 | P6 | O46 | 104.6° | 109.5° |
| O16 | C6 | C5 | 112.1° | 109.5° |
| O16 | C6 | H3 | 108.9° | 109.5° |
| O36 | P6 | O46 | 113.6° | 109.4° |
| P6 | O36 | H2 | 109.5° | 114.0° |
| P6 | O46 | H1 | 109.5° | 114.0° |
| C2 | C3 | O13 | 111.3° | 109.5° |
| C2 | C3 | C4 | 106.8° | 109.5° |
| C2 | C3 | H12 | 109.3° | 109.5° |
| C3 | C2 | H15 | 111.0° | 109.5° |
| C6 | C5 | O15 | 113.7° | 109.5° |
| C6 | C5 | C4 | 104.3° | 109.5° |
| C5 | C6 | H3 | 108.2° | 109.5° |
| C6 | C5 | H7 | 109.7° | 109.4° |
| O45 | P5 | O15 | 110.4° | 109.5° |
| O45 | P5 | O35 | 114.5° | 109.5° |
| P5 | O45 | H8 | 109.5° | 114.0° |
| O15 | P5 | O35 | 100.4° | 109.5° |
| P5 | O15 | C5 | 122.4° | 123.0° |
| P5 | O35 | H9 | 109.5° | 114.0° |
| O15 | C5 | C4 | 108.4° | 109.5° |
| O15 | C5 | H7 | 110.6° | 109.5° |
| O13 | C3 | C4 | 109.6° | 109.4° |
| C3 | O13 | P3 | 119.4° | 123.0° |
| O13 | C3 | H12 | 110.3° | 109.5° |
| C3 | C4 | C5 | 108.6° | 109.4° |
| C3 | C4 | O14 | 108.7° | 109.5° |
| C3 | C4 | H10 | 109.7° | 109.5° |
| C4 | C3 | H12 | 109.6° | 109.5° |
| C5 | C4 | O14 | 109.3° | 109.5° |
| C4 | C5 | H7 | 109.8° | 109.4° |
| C5 | C4 | H10 | 109.5° | 109.5° |
| O23 | P3 | O13 | 108.7° | 109.5° |
| O23 | P3 | O43 | 109.9° | 109.5° |
| O23 | P3 | O33 | 122.6° | 109.5° |
| O13 | P3 | O43 | 102.6° | 109.5° |
| O13 | P3 | O33 | 106.9° | 109.4° |
| O14 | C4 | H10 | 111.0° | 109.5° |
| C4 | O14 | H11 | 109.5° | 114.0° |
| O43 | P3 | O33 | 104.4° | 109.5° |
| P3 | O43 | H13 | 109.5° | 114.0° |
| P3 | O33 | H14 | 109.5° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O31 | P1 | O21 | O41 | 120.6° | 120.0° |
| O31 | P1 | O21 | O11 | 132.0° | 120.0° |
| O31 | P1 | O41 | O11 | 113.3° | 120.0° |
| O31 | P1 | O11 | C1 | 145.6° | 55.0° |
| O31 | P1 | O41 | H5 | 0.0° | 180.0° |
| O31 | P1 | O21 | H6 | 0.0° | 60.0° |
| O21 | P1 | O41 | O11 | 117.9° | 120.0° |
| O21 | P1 | O11 | C1 | 8.8° | 175.0° |
| O21 | P1 | O41 | H5 | 128.9° | 60.0° |
| O41 | P1 | O11 | C1 | 103.5° | 65.0° |
| O41 | P1 | O21 | H6 | 120.6° | 60.0° |
| P1 | O11 | C1 | C2 | 98.8° | 120.0° |
| P1 | O11 | C1 | C6 | 142.5° | 120.0° |
| P1 | O11 | C1 | H4 | 22.5° | 0.0° |
| O11 | P1 | O41 | H5 | 113.3° | 60.0° |
| O11 | P1 | O21 | H6 | 132.0° | 180.0° |
| O42 | P2 | O12 | O22 | 121.5° | 120.0° |
| O42 | P2 | O12 | O32 | 117.1° | 120.0° |
| O42 | P2 | O22 | O32 | 133.6° | 120.0° |
| O42 | P2 | O12 | C2 | 139.2° | 55.0° |
| O42 | P2 | O22 | H16 | 0.0° | 59.9° |
| O42 | P2 | O32 | H17 | 0.0° | 180.0° |
| O11 | C1 | C2 | O12 | 74.9° | 60.0° |
| O11 | C1 | C2 | C6 | 113.3° | 120.0° |
| O11 | C1 | C2 | H4 | 123.4° | 120.0° |
| O11 | C1 | C6 | H4 | 121.2° | 120.0° |
| O11 | C1 | C6 | O16 | 61.1° | 60.0° |
| O11 | C1 | C2 | C3 | 169.3° | 180.0° |
| O11 | C1 | C6 | C5 | 175.8° | 180.0° |
| O11 | C1 | C6 | H3 | 58.3° | 60.0° |
| O11 | C1 | C2 | H15 | 48.7° | 60.0° |
| O26 | P6 | O16 | O36 | 120.9° | 120.0° |
| O26 | P6 | O16 | O46 | 121.2° | 120.0° |
| O26 | P6 | O16 | C6 | 172.5° | 55.0° |
| O26 | P6 | O36 | O46 | 133.5° | 120.1° |
| O26 | P6 | O46 | H1 | 0.0° | 180.0° |
| O26 | P6 | O36 | H2 | 0.0° | 60.0° |
| O12 | P2 | O22 | O32 | 114.6° | 120.0° |
| P2 | O12 | C2 | C1 | 135.9° | 120.0° |
| P2 | O12 | C2 | C3 | 108.5° | 120.0° |
| P2 | O12 | C2 | H15 | 13.7° | 0.0° |
| O12 | P2 | O22 | H16 | 111.8° | 179.9° |
| O12 | P2 | O32 | H17 | 109.2° | 60.0° |
| O22 | P2 | O12 | C2 | 17.7° | 175.0° |
| O22 | P2 | O32 | H17 | 135.2° | 60.0° |
| O32 | P2 | O12 | C2 | 103.7° | 65.0° |
| O32 | P2 | O22 | H16 | 133.6° | 60.1° |
| O25 | P5 | O45 | O15 | 111.1° | 119.9° |
| O25 | P5 | O45 | O35 | 136.5° | 120.0° |
| O25 | P5 | O15 | O35 | 119.3° | 120.0° |
| O25 | P5 | O15 | C5 | 83.6° | 55.0° |
| O25 | P5 | O45 | H8 | 0.0° | 180.0° |
| O25 | P5 | O35 | H9 | 0.0° | 60.1° |
| O12 | C2 | C1 | C3 | 115.8° | 120.0° |
| O12 | C2 | C1 | H15 | 123.7° | 120.0° |
| O12 | C2 | C1 | C6 | 171.8° | 180.0° |
| O12 | C2 | C3 | H15 | 123.2° | 120.0° |
| O12 | C2 | C3 | O13 | 64.7° | 60.0° |
| O12 | C2 | C3 | C4 | 175.8° | 180.0° |
| O12 | C2 | C1 | H4 | 48.5° | 60.0° |
| O12 | C2 | C3 | H12 | 57.3° | 60.0° |
| C2 | C1 | C6 | H4 | 122.4° | 120.0° |
| C2 | C1 | C6 | O16 | 177.6° | 180.0° |
| C1 | C2 | C3 | H15 | 119.8° | 120.0° |
| C2 | C1 | C6 | C5 | 59.3° | 60.0° |
| C1 | C2 | C3 | O13 | 178.3° | 180.0° |
| C1 | C2 | C3 | C4 | 58.7° | 60.0° |
| C2 | C1 | C6 | H3 | 58.2° | 60.0° |
| C1 | C2 | C3 | H12 | 59.7° | 60.0° |
| C1 | C6 | O16 | P6 | 146.2° | 120.0° |
| C1 | C6 | O16 | C5 | 120.9° | 120.0° |
| C1 | C6 | O16 | H3 | 119.4° | 120.0° |
| C6 | C1 | C2 | C3 | 55.9° | 60.0° |
| C1 | C6 | C5 | H3 | 117.9° | 120.0° |
| C1 | C6 | C5 | O15 | 53.0° | 60.0° |
| C1 | C6 | C5 | C4 | 64.9° | 60.0° |
| C1 | C6 | C5 | H7 | 177.5° | 180.0° |
| C6 | C1 | C2 | H15 | 64.6° | 60.0° |
| O16 | P6 | O36 | O46 | 111.0° | 120.0° |
| P6 | O16 | C6 | C5 | 92.9° | 120.0° |
| O16 | P6 | O46 | H1 | 117.3° | 60.0° |
| O16 | P6 | O36 | H2 | 115.5° | 180.0° |
| P6 | O16 | C6 | H3 | 26.9° | 0.0° |
| C6 | O16 | P6 | O36 | 51.6° | 175.0° |
| C6 | O16 | P6 | O46 | 66.3° | 65.0° |
| O16 | C6 | C5 | H3 | 120.1° | 120.0° |
| O16 | C6 | C5 | O15 | 69.0° | 60.0° |
| O16 | C6 | C5 | C4 | 173.1° | 180.0° |
| O16 | C6 | C1 | H4 | 60.1° | 60.0° |
| O16 | C6 | C5 | H7 | 55.5° | 60.0° |
| O36 | P6 | O46 | H1 | 134.3° | 60.0° |
| O46 | P6 | O36 | H2 | 133.5° | 60.1° |
| C2 | C3 | O13 | C4 | 117.9° | 120.0° |
| C2 | C3 | O13 | H12 | 121.4° | 120.0° |
| C2 | C3 | C4 | H12 | 118.2° | 120.0° |
| C2 | C3 | C4 | C5 | 70.3° | 60.0° |
| C2 | C3 | O13 | P3 | 143.0° | 120.0° |
| C2 | C3 | C4 | O14 | 170.9° | 180.0° |
| C3 | C2 | C1 | H4 | 67.3° | 60.0° |
| C2 | C3 | C4 | H10 | 49.3° | 60.0° |
| C6 | C5 | O15 | P5 | 103.0° | 120.0° |
| C6 | C5 | O15 | C4 | 115.5° | 120.0° |
| C6 | C5 | O15 | H7 | 123.9° | 120.0° |
| C6 | C5 | C4 | C3 | 71.6° | 60.0° |
| C6 | C5 | C4 | H7 | 117.5° | 120.0° |
| C6 | C5 | C4 | O14 | 170.0° | 180.0° |
| C5 | C6 | C1 | H4 | 63.0° | 60.0° |
| C6 | C5 | C4 | H10 | 48.2° | 60.0° |
| O45 | P5 | O15 | O35 | 121.2° | 120.1° |
| O45 | P5 | O15 | C5 | 156.9° | 65.0° |
| O45 | P5 | O35 | H9 | 135.2° | 59.9° |
| P5 | O15 | C5 | C4 | 141.5° | 120.0° |
| P5 | O15 | C5 | H7 | 21.0° | 0.0° |
| O15 | P5 | O45 | H8 | 111.0° | 60.1° |
| O15 | P5 | O35 | H9 | 106.6° | 179.9° |
| O35 | P5 | O15 | C5 | 35.6° | 175.0° |
| O35 | P5 | O45 | H8 | 136.5° | 60.0° |
| O15 | C5 | C4 | C3 | 50.0° | 60.1° |
| O15 | C5 | C4 | H7 | 121.0° | 120.0° |
| O15 | C5 | C4 | O14 | 68.4° | 60.0° |
| O15 | C5 | C6 | H3 | 170.9° | 180.0° |
| O15 | C5 | C4 | H10 | 169.7° | 180.0° |
| O13 | C3 | C4 | H12 | 121.1° | 120.0° |
| O13 | C3 | C4 | C5 | 169.0° | 180.0° |
| C3 | O13 | P3 | O23 | 92.2° | 55.0° |
| O13 | C3 | C4 | O14 | 50.2° | 60.0° |
| C3 | O13 | P3 | O43 | 24.1° | 175.0° |
| C3 | O13 | P3 | O33 | 133.6° | 65.0° |
| O13 | C3 | C4 | H10 | 71.3° | 60.0° |
| O13 | C3 | C2 | H15 | 58.5° | 60.0° |
| C3 | C4 | C5 | O14 | 118.4° | 120.0° |
| C3 | C4 | C5 | H10 | 119.8° | 120.0° |
| C4 | C3 | O13 | P3 | 99.1° | 120.0° |
| C3 | C4 | O14 | H10 | 120.7° | 120.0° |
| C3 | C4 | C5 | H7 | 171.0° | 180.0° |
| C3 | C4 | O14 | H11 | 180.0° | 60.0° |
| C4 | C3 | C2 | H15 | 61.1° | 60.0° |
| C5 | C4 | O14 | H10 | 120.9° | 120.0° |
| C4 | C5 | C6 | H3 | 53.0° | 60.0° |
| C5 | C4 | O14 | H11 | 61.7° | 180.0° |
| C5 | C4 | C3 | H12 | 47.9° | 60.0° |
| O23 | P3 | O13 | O43 | 116.3° | 120.0° |
| O23 | P3 | O13 | O33 | 134.2° | 120.0° |
| O23 | P3 | O43 | O33 | 133.2° | 120.0° |
| O23 | P3 | O43 | H13 | 0.0° | 60.0° |
| O23 | P3 | O33 | H14 | 0.0° | 179.9° |
| O13 | P3 | O43 | O33 | 111.4° | 120.0° |
| P3 | O13 | C3 | H12 | 21.6° | 0.0° |
| O13 | P3 | O43 | H13 | 115.5° | 180.0° |
| O13 | P3 | O33 | H14 | 126.3° | 60.1° |
| O14 | C4 | C5 | H7 | 52.6° | 60.0° |
| O14 | C4 | C3 | H12 | 70.9° | 60.0° |
| O43 | P3 | O33 | H14 | 125.5° | 59.9° |
| O33 | P3 | O43 | H13 | 133.1° | 60.0° |
| H3 | C6 | C1 | H4 | 179.5° | NaN° |
| H3 | C6 | C5 | H7 | 64.6° | 60.0° |
| H4 | C1 | C2 | H15 | 172.1° | 180.0° |
| H7 | C5 | C4 | H10 | 69.2° | 60.0° |
| H10 | C4 | O14 | H11 | 59.3° | 60.0° |
| H10 | C4 | C3 | H12 | 167.6° | 180.0° |
| H12 | C3 | C2 | H15 | 179.5° | 180.0° |
