40
Energy =
C    -2.2809854   -0.0704864   -0.4436826 
C    -2.1082912   -1.3675589   -0.9307674 
C    -2.9345225   -2.4003589   -0.5103857 
C    -3.9679195   -2.1714315    0.4005358 
C    -4.1401144   -0.8733118    0.8789024 
C    -3.3082733    0.1609078    0.4661578 
C    -4.8839781   -3.2864566    0.8290919 
C    -1.3634629    1.0524955   -0.8690145 
N     0.0177486    0.7459206   -0.4539155 
C    -1.3848106    1.3988564   -2.3426563 
C    -2.2431682    0.9502318   -3.2476595 
C     0.8786175    1.7111835   -0.0554075 
O     0.5902991    2.8971306   -0.0220945 
C     2.2524694    1.2484881    0.3634804 
C     2.8542535    0.0977864   -0.1359519 
C     4.1406233   -0.2283043    0.2712139 
C     4.8526291    0.5469027    1.1684147 
C     4.2261095    1.6847251    1.6521540 
C     2.9519038    2.0559481    1.2594336 
N     4.9567373    2.5351234    2.6249650 
O     6.1012877    2.2159871    2.8983369 
O     4.3626399    3.4933195    3.0868426 
N     4.7768123   -1.4479553   -0.2796531 
O     5.9230996   -1.6855744    0.0567417 
O     4.1075777   -2.1362249   -1.0339328 
H    -1.3320221   -1.5698277   -1.6590093 
H    -2.7783049   -3.3993157   -0.8992249 
H    -4.9314221   -0.6675722    1.5893125 
H    -3.4584305    1.1584782    0.8599654 
H    -4.3612304   -4.2429432    0.8579629 
H    -5.3049085   -3.0980570    1.8168579 
H    -5.7189908   -3.3921410    0.1317482 
H    -1.6344650    1.9587510   -0.3230013 
H     0.2640143   -0.2233901   -0.3541141 
H    -0.6201349    2.1142862   -2.6263897 
H    -2.1894067    1.2829361   -4.2757315 
H    -3.0265342    0.2465753   -2.9990812 
H     2.3634642   -0.5380594   -0.8568973 
H     5.8508314    0.2803658    1.4748673 
H     2.5002575    2.9625696    1.6315831 
