45  ENERGY = -23.1  04/06/26 20:07:27_ 04/06/26 20:07:27
    1 U       0    2    0    1
    2 G       1    3   44    2
    3 A       2    4   43    3
    4 G       3    5   42    4
    5 G       4    6   41    5
    6 U       5    7   40    6
    7 A       6    8   39    7
    8 G       7    9   38    8
    9 U       8   10   37    9
   10 A       9   11   36   10
   11 G      10   12   35   11
   12 G      11   13    0   12
   13 U      12   14    0   13
   14 U      13   15    0   14
   15 G      14   16    0   15
   16 U      15   17   30   16
   17 A      16   18   29   17
   18 U      17   19   28   18
   19 A      18   20   27   19
   20 G      19   21   26   20
   21 U      20   22   25   21
   22 I      21   23    0    0
   23 I      22   24    0    0
   24 I      23   25    0    0
   25 A      24   26   21    1
   26 C      25   27   20    2
   27 U      26   28   19    3
   28 A      27   29   18    4
   29 U      28   30   17    5
   30 A      29   31   16    6
   31 G      30   32    0    7
   32 U      31   33    0    8
   33 A      32   34    0    9
   34 G      33   35    0   10
   35 C      34   36   11   11
   36 U      35   37   10   12
   37 A      36   38    9   13
   38 C      37   39    8   14
   39 U      38   40    7   15
   40 A      39   41    6   16
   41 C      40   42    5   17
   42 C      41   43    4   18
   43 U      42   44    3   19
   44 C      43   45    2   20
   45 A      44    0    0   21
   45  ENERGY = -23.0  04/06/26 20:07:27_ 04/06/26 20:07:27
    1 U       0    2   45    1
    2 G       1    3   44    2
    3 A       2    4   43    3
    4 G       3    5   42    4
    5 G       4    6   41    5
    6 U       5    7   40    6
    7 A       6    8   39    7
    8 G       7    9   38    8
    9 U       8   10   37    9
   10 A       9   11   36   10
   11 G      10   12   35   11
   12 G      11   13    0   12
   13 U      12   14    0   13
   14 U      13   15    0   14
   15 G      14   16    0   15
   16 U      15   17   30   16
   17 A      16   18   29   17
   18 U      17   19   28   18
   19 A      18   20   27   19
   20 G      19   21   26   20
   21 U      20   22   25   21
   22 I      21   23    0    0
   23 I      22   24    0    0
   24 I      23   25    0    0
   25 A      24   26   21    1
   26 C      25   27   20    2
   27 U      26   28   19    3
   28 A      27   29   18    4
   29 U      28   30   17    5
   30 A      29   31   16    6
   31 G      30   32    0    7
   32 U      31   33    0    8
   33 A      32   34    0    9
   34 G      33   35    0   10
   35 C      34   36   11   11
   36 U      35   37   10   12
   37 A      36   38    9   13
   38 C      37   39    8   14
   39 U      38   40    7   15
   40 A      39   41    6   16
   41 C      40   42    5   17
   42 C      41   43    4   18
   43 U      42   44    3   19
   44 C      43   45    2   20
   45 A      44    0    1   21
   45  ENERGY = -22.4  04/06/26 20:07:27_ 04/06/26 20:07:27
    1 U       0    2    0    1
    2 G       1    3   44    2
    3 A       2    4   43    3
    4 G       3    5   42    4
    5 G       4    6   41    5
    6 U       5    7   40    6
    7 A       6    8   39    7
    8 G       7    9   38    8
    9 U       8   10   37    9
   10 A       9   11   36   10
   11 G      10   12    0   11
   12 G      11   13   35   12
   13 U      12   14   34   13
   14 U      13   15   33   14
   15 G      14   16   32   15
   16 U      15   17   30   16
   17 A      16   18   29   17
   18 U      17   19   28   18
   19 A      18   20   27   19
   20 G      19   21   26   20
   21 U      20   22   25   21
   22 I      21   23    0    0
   23 I      22   24    0    0
   24 I      23   25    0    0
   25 A      24   26   21    1
   26 C      25   27   20    2
   27 U      26   28   19    3
   28 A      27   29   18    4
   29 U      28   30   17    5
   30 A      29   31   16    6
   31 G      30   32    0    7
   32 U      31   33   15    8
   33 A      32   34   14    9
   34 G      33   35   13   10
   35 C      34   36   12   11
   36 U      35   37   10   12
   37 A      36   38    9   13
   38 C      37   39    8   14
   39 U      38   40    7   15
   40 A      39   41    6   16
   41 C      40   42    5   17
   42 C      41   43    4   18
   43 U      42   44    3   19
   44 C      43   45    2   20
   45 A      44    0    0   21