59   1
0  C      0.00000      0.00000      0.00000
1  FE      4.80498      0.20151     -0.06148
2  N      5.17297     -1.74632     -0.33980
3  C      5.78853     -4.40646     -1.00642
4  C      5.44149     -2.65896      0.63003
5  C      5.20105     -2.14274     -1.65396
6  C      5.50910     -3.46762     -2.01229
7  C      5.75217     -3.99480      0.33848
8  N      4.69564      0.16412     -2.06172
9  C      4.48223     -0.18139     -4.84269
10  C      4.88819     -1.07412     -2.62308
11  C      4.40411      1.21603     -2.86965
12  C      4.29017      1.08531     -4.26124
13  C      4.78525     -1.27196     -4.01201
14  N      6.78210      0.51005      0.00297
15  C      9.55365      0.81046      0.36374
16  C      7.60715      0.66263     -1.06559
17  C      7.32130      0.50832      1.26566
18  C      8.70502      0.65322      1.47126
19  C      8.99411      0.81738     -0.92714
20  N      5.04667      0.14514      1.92654
21  C      5.63772      0.22180      4.67338
22  C      6.33655      0.34374      2.35276
23  C      4.06457     -0.01564      2.85116
24  C      4.31873      0.01453      4.22974
25  C      6.65656      0.38818      3.72186
26  N      2.81067     -0.00000      0.00000
27  C      2.11807     -1.16399     -0.10397
28  C      2.11690      1.18077      0.10345
29  C      0.71038      1.20618      0.10618
30  C      0.71649     -1.20567     -0.10628
31  N      4.31578      2.13747      0.10754
32  C      3.37293      4.76209      0.46063
33  C      2.96770      2.38351      0.20356
34  C      5.18276      3.18047      0.18670
35  C      4.75182      4.50380      0.35986
36  C      2.47233      3.68782      0.38200
37  H      5.39956     -2.31165      1.65323
38  H      5.53450     -3.76522     -3.05313
39  H      5.95855     -4.68542      1.14840
40  H      6.02794     -5.43226     -1.26656
41  H      4.26618      2.17527     -2.39098
42  H      4.05686      1.95624     -4.86332
43  H      4.93500     -2.25489     -4.44199
44  H      4.39908     -0.31765     -5.91590
45  H      7.14616      0.66712     -2.04342
46  H      9.11829      0.64290      2.47234
47  H      9.61021      0.93904     -1.81093
48  H     10.62310      0.92550      0.50623
49  H      3.06357     -0.17735      2.47674
50  H      3.50046     -0.12172      4.92782
51  H      7.67754      0.55086      4.04450
52  H      5.86849      0.25296      5.73315
53  H      2.69489     -2.07552     -0.17437
54  H      0.17621      2.14504      0.18506
55  H      0.20955     -2.16073     -0.18726
56  H      6.23575      2.95159      0.09849
57  H      5.48324      5.30257      0.41189
58  H      1.40699      3.86730      0.46097
59  H      3.00689      5.77424      0.59715
