3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 1
  O       0.203330     -0.630726      0.000000
  O       0.771324      0.447285      0.000000
  H      -0.786074      3.011366      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 2
  O       0.006047     -0.003738      0.000000
  O       1.224251      0.026474      0.000000
  H       2.749179      2.550340      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 3
  O       0.006727     -0.002829      0.000000
  O       1.224950      0.025594      0.000000
  H       2.792512      2.462520      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 4
  O       0.021797      0.041999      0.000000
  O       1.239190     -0.011236      0.000000
  H       2.800099      2.368937      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 5
  O       0.006232     -0.003004      0.000000
  O       1.224434      0.025960      0.000000
  H       2.661881      2.423137      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 6
  O       0.017651      0.031089      0.000000
  O       1.235776     -0.001629      0.000000
  H       2.677687      2.332872      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 7
  O       0.006198     -0.002649      0.000000
  O       1.224391      0.025766      0.000000
  H       2.585249      2.349256      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 8
  O       0.016784      0.028424      0.000000
  O       1.234993      0.000616      0.000000
  H       2.599942      2.262084      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 9
  O       0.011049      0.012994      0.000000
  O       1.229642      0.013494      0.000000
  H       2.509346      2.265542      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 10
  O       0.011254      0.013360      0.000000
  O       1.229781      0.013228      0.000000
  H       2.476780      2.224934      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 11
  O       0.010557      0.011484      0.000000
  O       1.229079      0.014739      0.000000
  H       2.444177      2.185617      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 12
  O       0.010629      0.011566      0.000000
  O       1.229159      0.014635      0.000000
  H       2.418158      2.141424      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 13
  O       0.010708      0.011681      0.000000
  O       1.229260      0.014506      0.000000
  H       2.391452      2.097600      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 14
  O       0.013050      0.018148      0.000000
  O       1.231622      0.009331      0.000000
  H       2.359455      2.052914      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 15
  O       0.010469      0.011334      0.000000
  O       1.229119      0.014933      0.000000
  H       2.310637      2.025423      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 16
  O       0.011834      0.015031      0.000000
  O       1.230609      0.011950      0.000000
  H       2.282317      1.980307      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 17
  O       0.010431      0.011284      0.000000
  O       1.229293      0.015010      0.000000
  H       2.244562      1.944714      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 18
  O       0.011780      0.014959      0.000000
  O       1.230906      0.012026      0.000000
  H       2.216214      1.899605      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 19
  O       0.010369      0.011230      0.000000
  O       1.229668      0.015089      0.000000
  H       2.178985      1.863624      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 20
  O       0.011599      0.014656      0.000000
  O       1.231385      0.012281      0.000000
  H       2.150789      1.818585      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 21
  O       0.010848      0.012937      0.000000
  O       1.231209      0.013727      0.000000
  H       2.113405      1.781426      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 22
  O       0.010796      0.012980      0.000000
  O       1.231901      0.013696      0.000000
  H       2.081364      1.740453      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 23
  O       0.010593      0.012807      0.000000
  O       1.232734      0.013830      0.000000
  H       2.049359      1.699621      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 24
  O       0.010455      0.012977      0.000000
  O       1.234083      0.013672      0.000000
  H       2.017780      1.658459      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 25
  O       0.010187      0.012880      0.000000
  O       1.235778      0.013737      0.000000
  H       1.985921      1.617725      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 26
  O       0.009831      0.012880      0.000000
  O       1.238119      0.013703      0.000000
  H       1.954498      1.576880      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 27
  O       0.009356      0.012922      0.000000
  O       1.241343      0.013617      0.000000
  H       1.923305      1.536158      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 28
  O       0.008719      0.013016      0.000000
  O       1.245767      0.013471      0.000000
  H       1.892309      1.495669      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 29
  O       0.007883      0.013166      0.000000
  O       1.251795      0.013260      0.000000
  H       1.861505      1.455533      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 30
  O       0.006825      0.013435      0.000000
  O       1.259952      0.012938      0.000000
  H       1.830865      1.415855      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 31
  O       0.005617      0.013796      0.000000
  O       1.270704      0.012559      0.000000
  H       1.800291      1.376788      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 32
  O       0.004443      0.014219      0.000000
  O       1.284251      0.012202      0.000000
  H       1.769734      1.338325      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 33
  O       0.003787      0.014406      0.000000
  O       1.299848      0.012216      0.000000
  H       1.739377      1.300264      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 34
  O       0.003836      0.014139      0.000000
  O       1.315829      0.012778      0.000000
  H       1.709813      1.261872      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 35
  O       0.003665      0.015936      0.000000
  O       1.334072      0.011601      0.000000
  H       1.678938      1.221965      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 36
  O       0.004501      0.019532      0.000000
  O       1.356015      0.009403      0.000000
  H       1.641231      1.182547      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 37
  O       0.006354      0.008164      0.000000
  O       1.361089      0.019280      0.000000
  H       1.612078      1.147804      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 38
  O       0.006533      0.007577      0.000000
  O       1.363702      0.019720      0.000000
  H       1.599566      1.099129      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 39
  O       0.006665      0.007025      0.000000
  O       1.365619      0.020118      0.000000
  H       1.587675      1.050112      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 40
  O       0.006822      0.006569      0.000000
  O       1.366990      0.020436      0.000000
  H       1.576192      1.000802      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 41
  O       0.007042      0.006107      0.000000
  O       1.367714      0.020761      0.000000
  H       1.564908      0.951316      0.000000
 
3
Coordinates from ORCA-job o2H2 Relaxed Surface Scan Step 42
  O       0.007049      0.005734      0.000000
  O       1.368073      0.020985      0.000000
  H       1.553584      0.901658      0.000000

