48
oxyheme-hexa
O -0.040000 -1.135000 -2.789000
O -0.024000 -0.045000 -2.145000
H 2.685000 4.556000 -0.558000
H 4.601000 2.590000 -0.572000
H 4.530000 -2.682000 -0.332000
H 2.568000 -4.594000 -0.143000
H -2.702000 -4.524000 -0.102000
H -4.614000 -2.561000 -0.265000
H -4.551000 2.708000 -0.507000
H -2.584000 4.625000 -0.518000
C -0.629000 0.262000 3.867000
C -1.074000 0.198000 2.559000
N 0.753000 0.239000 3.788000
C 1.104000 0.163000 2.471000
N 1.438000 1.424000 -0.424000
N 0.013000 0.136000 1.707000
H -1.163000 0.321000 4.821000
H 1.404000 0.272000 4.574000
H -2.101000 0.192000 2.180000
H 2.139000 0.130000 2.112000
N 1.397000 -1.432000 -0.272000
N -1.417000 1.461000 -0.401000
C 0.036000 3.457000 -0.454000
C 3.431000 -0.033000 -0.429000
C -0.052000 -3.427000 -0.126000
C -3.447000 0.057000 -0.382000
C 1.267000 2.794000 -0.459000
C 2.768000 -1.262000 -0.338000
C -1.281000 -2.765000 -0.171000
C -2.788000 1.290000 -0.424000
C 2.552000 3.467000 -0.519000
C 3.441000 -2.546000 -0.289000
C -2.566000 -3.436000 -0.158000
C -3.462000 2.575000 -0.476000
C 3.510000 2.484000 -0.525000
C 2.460000 -3.503000 -0.195000
C -3.522000 -2.454000 -0.238000
C -2.479000 3.533000 -0.482000
C 2.803000 1.217000 -0.465000
C 1.193000 -2.798000 -0.191000
C -2.815000 -1.188000 -0.297000
C -1.211000 2.826000 -0.439000
N -1.449000 -1.394000 -0.249000
Fe -0.010000 -0.005000 -0.380000
H 0.050000 4.556000 -0.487000
H 4.530000 -0.052000 -0.476000
H -0.066000 -4.525000 -0.065000
H -4.547000 0.067000 -0.413000

