PUT KEYWORDS HERE
REAL300009850845

C    0.000000  1    0.000000  1    0.000000  1     0   0   0
N    1.464996  1    0.000000  1    0.000000  1     1   0   0
N    1.399241  1  125.837364  1    0.000000  1     2   1   0
C    1.307369  1  109.159703  1  180.275493  1     3   2   1
C    1.406690  1  108.334228  1  359.742213  1     4   3   2
C    1.474402  1  126.449757  1  180.025623  1     5   4   3
O    1.223039  1  119.999142  1  359.974377  1     6   5   4
O    1.223002  1  120.001946  1  179.974377  1     6   5   4
C    1.351537  1  125.832905  1  179.818149  1     2   1   3
C    1.475787  1  126.466353  1  359.974377  1     9   2   1
O    1.215688  1  119.999156  1   99.183084  1    10   9   2
N    1.347791  1  120.002574  1  279.184802  1    10   9   2
C    1.475301  1  125.655414  1  354.823466  1    12  10   9
C    1.551408  1  104.994480  1  203.909233  1    13  12  10
C    1.539444  1  101.424323  1  324.254452  1    14  13  12
C    1.524970  1  115.787445  1  264.925900  1    15  14  13
C    1.540175  1   86.680050  1  217.223600  1    16  15  14
C    1.530016  1  113.575737  1  139.078223  1    17  16  15
Xx   1.570017  1  109.473389  1  176.408437  1    18  17  16
O    1.420005  1  119.997534  1  270.000477  1    19  18  17
O    1.420026  1  120.000794  1   89.997954  1    19  18  17
C    1.526583  1  115.857182  1  163.343516  1    15  14  13
C    1.473317  1  125.662055  1  174.804865  1    12  10   9
H    1.090006  1  109.475977  1  275.109319  1     1   2   3
H    1.090023  1  109.466556  1   35.115525  1     1   2   3
H    1.090045  1  109.468387  1  155.107978  1     1   2   3
H    1.079973  1  125.834768  1  179.779633  1     4   3   2
H    1.089999  1  110.340421  1  322.789936  1    13  12  10
H    1.089987  1  110.339458  1   85.028445  1    13  12  10
H    1.090043  1  111.031222  1  206.215227  1    14  13  12
H    1.089971  1  111.031014  1   82.295770  1    14  13  12
H    1.090004  1  113.681804  1  102.777332  1    16  15  14
H    1.090056  1  113.767822  1  331.677370  1    16  15  14
H    1.090005  1  113.573676  1  269.779467  1    17  16  15
H    1.090025  1  109.472065  1  296.407074  1    18  17  16
H    1.090051  1  109.469518  1   56.405310  1    18  17  16
H    0.967019  1  113.997317  1  179.974377  1    20  19  18
H    0.966959  1  113.998664  1  180.025623  1    21  19  18
H    1.089940  1  113.679216  1   28.290053  1    22  15  14
H    1.090077  1  113.723986  1  257.137779  1    22  15  14
H    1.090089  1  109.976707  1   58.704759  1    23  12  10
H    1.090028  1  110.011682  1  297.442938  1    23  12  10