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Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C15S14sing1.81Å1.79Å
S14C13sing1.76Å1.78Å
C13N12doub1.33Å1.35ÅAromatic
C13N16sing1.33Å1.35ÅAromatic
N12C05sing1.33Å1.38ÅAromatic
C23C22sing1.55Å1.53Å
C23C19sing1.54Å1.55Å
N16C17doub1.33Å1.38ÅAromatic
C22C21sing1.55Å1.52Å
C05N06sing1.39Å1.38Å
C05C04doub1.39Å1.41ÅAromatic
N06C07sing1.47Å1.48Å
C17C04sing1.39Å1.42ÅAromatic
C17N18sing1.39Å1.39Å
C19N18sing1.47Å1.47Å
C19C20sing1.54Å1.54Å
C04N02sing1.48Å1.44Å
O01N02doub1.22Å1.20Å
C21C20sing1.54Å1.53Å
C11C07sing1.54Å1.55Å
C11C10sing1.55Å1.52Å
N02O03sing1.22Å1.21Å
C07C08sing1.54Å1.55Å
C10C09sing1.55Å1.52Å
C08C09sing1.54Å1.53Å
C07H1sing1.09Å1.10Å
C08H2sing1.09Å1.10Å
C08H3sing1.09Å1.10Å
C09H4sing1.09Å1.10Å
C09H5sing1.09Å1.10Å
C10H6sing1.09Å1.10Å
C10H7sing1.09Å1.10Å
C11H8sing1.09Å1.10Å
C11H9sing1.09Å1.10Å
C15H10sing1.09Å1.10Å
C15H11sing1.09Å1.10Å
C15H12sing1.09Å1.10Å
C19H13sing1.09Å1.10Å
C20H14sing1.09Å1.10Å
C20H15sing1.09Å1.10Å
C21H16sing1.09Å1.10Å
C21H17sing1.09Å1.10Å
C22H18sing1.09Å1.10Å
C22H19sing1.09Å1.10Å
C23H20sing1.09Å1.10Å
C23H21sing1.09Å1.10Å
N06H22sing0.97Å1.00Å
N18H23sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C15S14C13112.2°100.0°
S14C15H10109.5°109.5°
S14C15H11109.5°109.5°
S14C15H12109.5°109.5°
S14C13N12113.3°119.2°
S14C13N16116.5°119.2°
N12C13N16130.2°121.7°
C13N12C05115.8°120.8°
C13N16C17115.3°120.8°
N12C05N06119.4°120.4°
N12C05C04117.9°119.1°
C22C23C19106.9°104.2°
C23C22C21106.2°102.7°
C23C22H18110.3°110.7°
C23C22H19110.3°111.0°
C22C23H20110.2°110.5°
C22C23H21110.1°110.4°
C23C19N18111.2°110.0°
C23C19C20101.4°106.6°
C23C19H13109.2°110.1°
C19C23H20110.1°110.5°
C19C23H21110.1°110.5°
N16C17C04118.3°119.1°
N16C17N18120.5°120.4°
C22C21C20106.8°104.2°
C22C21H16110.2°110.5°
C22C21H17110.1°110.6°
C21C22H18110.3°110.7°
C21C22H19110.3°110.7°
N06C05C04122.6°120.4°
C05N06C07125.9°120.0°
C05N06H22105.2°120.0°
C05C04C17122.4°118.4°
C05C04N02118.3°120.8°
N06C07C11112.8°110.1°
N06C07C08114.0°110.1°
N06C07H1109.8°110.0°
C07N06H22105.2°119.9°
C04C17N18121.2°120.4°
C17C04N02119.4°120.8°
C17N18C19128.4°120.0°
C17N18H23104.5°120.0°
N18C19C20114.9°110.0°
N18C19H13110.3°110.0°
C19N18H23104.6°120.0°
C19C20C21106.5°106.5°
C20C19H13109.4°110.0°
C19C20H14110.2°110.0°
C19C20H15110.2°110.1°
C04N02O01118.9°120.0°
C04N02O03117.1°120.0°
O01N02O03123.9°120.0°
C21C20H14110.2°110.0°
C21C20H15110.2°110.1°
C20C21H16110.1°110.5°
C20C21H17110.2°110.4°
C07C11C10108.5°104.2°
C11C07C08102.0°106.6°
C11C07H1109.0°110.0°
C07C11H8109.7°110.5°
C07C11H9109.7°110.5°
C11C10C09105.9°102.8°
C11C10H6110.4°110.8°
C11C10H7110.4°110.9°
C10C11H8109.7°110.5°
C10C11H9109.7°110.5°
C07C08C09109.7°106.6°
C08C07H1109.0°110.0°
C07C08H2109.5°110.1°
C07C08H3109.4°110.0°
C10C09C08106.9°104.2°
C10C09H4110.1°110.5°
C10C09H5110.1°110.6°
C09C10H6110.4°110.7°
C09C10H7110.3°110.8°
C09C08H2109.4°110.0°
C09C08H3109.4°110.1°
C08C09H4110.1°110.5°
C08C09H5110.1°110.5°
H2C08H3109.4°110.0°
H4C09H5109.5°110.5°
H6C10H7109.5°110.6°
H8C11H9109.5°110.5°
H10C15H11109.5°109.5°
H10C15H12109.5°109.4°
H11C15H12109.4°109.5°
H14C20H15109.5°110.0°
H16C21H17109.4°110.4°
H18C22H19109.4°110.7°
H20C23H21109.4°110.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C15S14C13N1273.2°180.0°
C15S14C13N16106.5°0.2°
S14C15H10H11120.0°120.0°
S14C15H10H12120.0°120.0°
S14C15H11H12120.0°120.0°
S14C13N12N16179.6°179.8°
S14C13N12C05179.9°179.9°
S14C13N16C17179.8°180.0°
C13S14C15H10180.0°60.0°
C13S14C15H1160.0°180.0°
C13S14C15H1260.0°60.0°
N12C13N16C170.2°0.2°
C13N12C05N06179.8°180.0°
C13N12C05C040.2°0.1°
N16C13N12C050.3°0.3°
C13N16C17C040.0°0.1°
C13N16C17N18179.7°180.0°
N12C05N06C04180.0°179.9°
N12C05N06C07111.4°0.1°
N12C05C04C170.0°0.2°
N12C05C04N02179.7°180.0°
N12C05N06H22126.4°179.9°
C22C23C19H20119.6°118.7°
C22C23C19H21119.6°118.7°
C23C22C21H18119.5°118.3°
C23C22C21H19119.5°118.5°
C22C23C19N1890.0°142.9°
C22C23C19C2032.6°23.6°
C23C22C21C202.3°37.9°
C22C23C19H13148.1°95.7°
C23C22C21H16117.2°156.6°
C23C22C21H17122.0°80.8°
C23C22H18H19121.5°123.5°
C22C23H20H21121.2°122.6°
C19C23C22C2119.3°37.9°
C23C19N18C1776.1°87.8°
C23C19N18C20114.4°117.2°
C23C19N18H13121.3°121.4°
C23C19C20H13115.3°119.4°
C23C19C20C2134.0°0.0°
C23C19C20H1485.5°119.2°
C23C19C20H15153.5°119.3°
C19C23C22H18100.3°80.4°
C19C23C22H19138.8°156.3°
C19C23H20H21121.2°122.7°
C23C19N18H23161.4°92.2°
N16C17C04C050.0°0.3°
N16C17C04N18179.7°179.9°
N16C17N18C19102.3°0.0°
N16C17C04N02179.8°180.0°
N16C17N18H23135.2°180.0°
C22C21C20C1923.3°23.6°
C22C21C20H16119.6°118.7°
C22C21C20H17119.6°118.8°
C22C21C20H1496.2°95.6°
C22C21C20H15142.9°142.9°
C22C21H16H17121.2°122.7°
C21C22H18H19121.5°123.2°
C21C22C23H20100.3°80.8°
C21C22C23H21138.9°156.6°
C05N06C07H22122.2°179.9°
N06C05C04C17180.0°179.7°
N06C05C04N020.2°0.1°
C05N06C07C11131.0°87.8°
C05N06C07C0815.3°155.0°
C05N06C07H1107.3°33.6°
C04C05N06C0768.7°180.0°
C05C04C17N02179.8°179.8°
C05C04C17N18179.8°179.8°
C05C04N02O0153.6°90.1°
C05C04N02O03126.4°90.0°
C04C05N06H2253.6°0.0°
N06C07C11C08122.7°119.3°
N06C07C11H1122.2°121.4°
N06C07C11C1096.8°95.7°
N06C07C08H1123.1°121.3°
N06C07C08C09106.0°119.3°
N06C07C08H214.0°0.0°
N06C07C08H3134.0°121.3°
N06C07C11H8143.3°145.6°
N06C07C11H923.0°23.0°
C04C17N18C1978.0°180.0°
C17C04N02O01126.2°89.7°
C17C04N02O0353.8°90.2°
C04C17N18H2344.5°0.1°
C17N18C19H23122.5°180.0°
C17N18C19C20169.5°154.9°
N18C17C04N020.5°0.0°
C17N18C19H1345.2°33.6°
N18C19C20H13124.7°121.3°
N18C19C20C2186.0°119.3°
N18C19C20H14154.5°121.4°
N18C19C20H1533.5°0.0°
N18C19C23H20150.4°24.2°
N18C19C23H2129.6°98.4°
C19C20C21H14119.5°119.2°
C19C20C21H15119.5°119.3°
C19C20H14H15121.4°121.4°
C19C20C21H1696.3°142.3°
C19C20C21H17142.9°95.2°
C20C19C23H2087.0°95.1°
C20C19C23H21152.2°142.3°
C20C19N18H2347.0°25.0°
C04N02O01O03180.0°179.9°
C21C20C19H13149.3°119.3°
C21C20H14H15121.3°121.5°
C20C21H16H17121.2°122.5°
C20C21C22H18121.8°80.4°
C20C21C22H19117.2°156.4°
C07C11C10H8119.8°118.7°
C07C11C10H9119.8°118.7°
C11C07C08H1115.1°119.3°
C07C11C10C0926.5°37.9°
C11C07C08C0915.9°0.0°
C11C07C08H2135.9°119.3°
C11C07C08H3104.2°119.3°
C07C11C10H6145.9°80.4°
C07C11C10H792.9°156.4°
C07C11H8H9120.5°122.6°
C11C07N06H22106.8°92.3°
C10C11C07C0825.8°23.6°
C11C10C09H6119.5°118.3°
C11C10C09H7119.4°118.5°
C11C10C09C0815.7°37.9°
C10C11C07H1140.9°142.9°
C11C10C09H4103.9°156.6°
C11C10C09H5135.2°80.8°
C11C10H6H7121.7°123.4°
C10C11H8H9120.4°122.6°
C07C08C09C100.5°23.6°
C07C08C09H2120.1°119.3°
C07C08C09H3120.0°119.3°
C07C08H2H3119.9°121.4°
C07C08C09H4120.1°142.3°
C07C08C09H5119.1°95.2°
C08C07C11H894.0°95.1°
C08C07C11H9145.6°142.3°
C08C07N06H22137.5°25.0°
C10C09C08H4119.6°118.7°
C10C09C08H5119.6°118.7°
C10C09C08H2120.6°95.8°
C10C09C08H3119.5°142.9°
C10C09H4H5121.2°122.6°
C09C10H6H7121.6°123.3°
C09C10C11H893.3°80.7°
C09C10C11H9146.3°156.6°
C09C08C07H1130.9°119.3°
C09C08H2H3119.9°121.4°
C08C09H4H5121.2°122.6°
C08C09C10H6135.1°80.4°
C08C09C10H7103.8°156.4°
H1C07C08H2109.0°121.4°
H1C07C08H310.9°0.0°
H1C07C11H821.1°24.2°
H1C07C11H999.3°98.4°
H1C07N06H2214.9°146.3°
H2C08C09H4119.9°22.9°
H2C08C09H51.0°145.5°
H3C08C09H40.0°98.4°
H3C08C09H5120.9°24.1°
H4C09C10H615.5°38.3°
H4C09C10H7136.7°84.9°
H5C09C10H6105.3°160.9°
H5C09C10H715.8°37.7°
H6C10C11H826.1°160.9°
H6C10C11H994.2°38.3°
H7C10C11H8147.2°37.7°
H7C10C11H926.9°85.0°
H10C15H11H12120.0°119.9°
H13C19C20H1429.8°0.1°
H13C19C20H1591.2°121.3°
H13C19C23H2028.5°145.6°
H13C19C23H2192.3°22.9°
H13C19N18H2377.3°146.4°
H14C20C21H16144.2°23.1°
H14C20C21H1723.4°145.5°
H15C20C21H1623.3°98.4°
H15C20C21H1797.5°24.1°
H16C21C22H182.3°38.3°
H16C21C22H19123.3°84.9°
H17C21C22H18118.6°160.9°
H17C21C22H192.5°37.7°
H18C22C23H20140.2°161.0°
H18C22C23H2119.4°38.4°
H19C22C23H2019.2°37.6°
H19C22C23H21101.6°85.0°

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