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P4444.xyz
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P4444.xyz
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P4444+ il.ff
P3 -1.55069 -1.10117 0.80137
C1P 0.13685 -0.41966 0.76957
C1P -1.49426 -2.91898 0.73190
C1P -2.49099 -0.50275 -0.63766
C1P -2.35505 -0.56446 2.34333
H1 0.63438 -0.68731 1.70452
H1 0.07083 0.67018 0.74250
H1 -1.95015 -0.77931 -1.54538
H1 -3.44992 -1.02541 -0.66443
H1 -1.04477 -3.21595 -0.21833
H1 -2.51832 -3.29894 0.73262
H1 -2.34064 0.52709 2.38027
H1 -1.76034 -0.91990 3.18769
C2 0.97997 -0.91635 -0.42280
C2 -0.70757 -3.55174 1.89770
C2 -2.73496 1.02020 -0.62493
C2 -3.80565 -1.06888 2.48428
HC 0.48420 -0.65086 -1.35935
HC 1.06072 -2.00507 -0.38693
HC 0.31511 -3.16743 1.90203
HC -1.17081 -3.27216 2.84679
HC -1.77747 1.54554 -0.59714
HC -3.29070 1.29534 0.27435
HC -3.81688 -2.16115 2.46931
HC -4.39996 -0.71948 1.63682
CT2 2.39470 -0.30131 -0.39895
CT2 -0.67520 -5.08934 1.77772
CT2 -3.52952 1.46741 -1.86940
CT2 -4.44371 -0.56876 3.79678
CT 3.24770 -0.81506 -1.57335
CT 0.10994 -5.72444 2.93985
CT -3.79737 2.98343 -1.84704
CT -5.89233 -1.07008 3.94058
HC 2.89063 -0.55333 0.54171
HC 2.32437 0.78785 -0.45382
HC 3.35751 -1.90095 -1.52399
HC 4.24379 -0.36804 -1.54062
HC 2.78586 -0.55504 -2.52864
HC -1.69557 -5.48077 1.77636
HC -0.21036 -5.37561 0.83095
HC -0.35099 -5.47512 3.89850
HC 0.12239 -6.81182 2.83762
HC 1.14290 -5.36865 2.94737
HC -5.92338 -2.16210 3.95048
HC -6.32706 -0.70600 4.87414
HC -6.50843 -0.71186 3.11252
HC -3.85575 -0.91793 4.64920
HC -4.43778 0.52388 3.81671
HC -4.35873 3.28105 -2.73548
HC -2.85810 3.54120 -1.83152
HC -4.38030 3.25896 -0.96499
HC -4.48329 0.93524 -1.90892
HC -2.97176 1.21315 -2.77415