0 mol 73 unq 0 iso 0 dist 5.82056 7.69222 3.32668 4.30874 5.5087 8.62198 6.97502 5.61588 6.45841 8.07446 numMergedOcc 0
1 mol 73 unq 0 iso 1 dist 5.82056 7.69222 3.32668 6.97502 5.61588 6.45841 4.30874 5.5087 8.62198 8.07446 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 5.82056 9.09115 5.30471 4.30874 5.5087 6.08682 6.97502 5.61588 7.83244 8.07446 numMergedOcc 0
3 mol 73 unq 1 iso 1 dist 5.82056 9.09115 5.30471 6.97502 5.61588 7.83244 4.30874 5.5087 6.08682 8.07446 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 9.09115 7.69222 8.07648 4.30874 6.08682 8.62198 6.97502 7.83244 6.45841 8.07446 numMergedOcc 0
5 mol 73 unq 2 iso 1 dist 9.09115 7.69222 8.07648 6.97502 7.83244 6.45841 4.30874 6.08682 8.62198 8.07446 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 9.09115 5.82056 5.30471 4.30874 6.08682 5.5087 6.97502 7.83244 5.61588 8.07446 numMergedOcc 0
7 mol 73 unq 3 iso 1 dist 9.09115 5.82056 5.30471 6.97502 7.83244 5.61588 4.30874 6.08682 5.5087 8.07446 numMergedOcc 0
8 mol 88 unq 0 iso 0 dist 9.76849 9.18365 4.88633 6.06775 7.51139 10.0565 14.7449 7.80898 10.5947 12.1547 numMergedOcc 0
9 mol 88 unq 0 iso 1 dist 9.76849 9.18365 4.88633 14.7449 7.80898 10.5947 6.06775 7.51139 10.0565 12.1547 numMergedOcc 0
10 mol 95 unq 0 iso 0 dist 8.23073 9.11547 10.3056 7.95165 8.27883 11.5783 6.67589 7.7152 14.2275 6.59884 numMergedOcc 0
11 mol 95 unq 0 iso 1 dist 8.23073 9.11547 10.3056 6.67589 7.7152 14.2275 7.95165 8.27883 11.5783 6.59884 numMergedOcc 0
12 mol 152 unq 0 iso 0 dist 9.17216 9.44172 3.55572 6.62991 6.59889 8.9192 13.4463 6.70693 9.27706 7.65448 numMergedOcc 0
13 mol 152 unq 0 iso 1 dist 9.17216 9.44172 3.55572 13.4463 6.70693 9.27706 6.62991 6.59889 8.9192 7.65448 numMergedOcc 0
14 mol 192 unq 0 iso 0 dist 6.98794 9.63224 5.9655 6.34098 5.64942 9.78634 9.57246 6.97962 12.8149 5.76246 numMergedOcc 0
15 mol 192 unq 0 iso 1 dist 6.98794 9.63224 5.9655 9.57246 6.97962 12.8149 6.34098 5.64942 9.78634 5.76246 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 8.94981 5.90986 8.05944 17.0867 8.1945 14.7849 6.89798 6.50998 9.09424 13.3965 numMergedOcc 0
17 mol 225 unq 0 iso 1 dist 8.94981 5.90986 8.05944 6.89798 6.50998 9.09424 17.0867 8.1945 14.7849 13.3965 numMergedOcc 0
18 mol 225 unq 1 iso 0 dist 8.94981 7.50697 13.7858 17.0867 8.1945 21.1757 6.89798 6.50998 8.14831 13.3965 numMergedOcc 0
19 mol 225 unq 1 iso 1 dist 8.94981 7.50697 13.7858 6.89798 6.50998 8.14831 17.0867 8.1945 21.1757 13.3965 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 9.67281 6.5311 13.167 7.01206 9.12776 9.3718 11.2453 9.72188 13.9517 15.7907 numMergedOcc 0
21 mol 238 unq 0 iso 1 dist 9.67281 6.5311 13.167 11.2453 9.72188 13.9517 7.01206 9.12776 9.3718 15.7907 numMergedOcc 0
22 mol 251 unq 0 iso 0 dist 6.17824 5.62261 3.63976 5.99541 9.82601 10.322 6.33949 6.50357 7.39775 5.19086 numMergedOcc 0
23 mol 251 unq 0 iso 1 dist 6.17824 5.62261 3.63976 6.33949 6.50357 7.39775 5.99541 9.82601 10.322 5.19086 numMergedOcc 0
24 mol 259 unq 0 iso 0 dist 8.40328 8.2518 3.51848 6.18571 5.85442 6.95511 12.3834 6.9899 10.4017 9.98105 numMergedOcc 0
25 mol 259 unq 0 iso 1 dist 8.40328 8.2518 3.51848 12.3834 6.9899 10.4017 6.18571 5.85442 6.95511 9.98105 numMergedOcc 0
26 mol 259 unq 1 iso 0 dist 8.2518 8.40328 3.51848 11.0067 9.46361 10.3406 6.18571 6.95511 5.85442 6.96053 numMergedOcc 0
27 mol 259 unq 1 iso 1 dist 8.2518 8.40328 3.51848 6.18571 6.95511 5.85442 11.0067 9.46361 10.3406 6.96053 numMergedOcc 0
28 mol 277 unq 0 iso 0 dist 9.91103 7.0603 3.39114 16.3552 9.57499 11.4389 10.4297 5.46926 5.13913 7.69449 numMergedOcc 0
29 mol 277 unq 0 iso 1 dist 9.91103 7.0603 3.39114 10.4297 5.46926 5.13913 16.3552 9.57499 11.4389 7.69449 numMergedOcc 0
30 mol 277 unq 1 iso 0 dist 9.91103 7.0603 3.39114 16.3552 9.57499 11.4389 5.77904 8.9682 6.92711 11.8268 numMergedOcc 0
31 mol 277 unq 1 iso 1 dist 9.91103 7.0603 3.39114 5.77904 8.9682 6.92711 16.3552 9.57499 11.4389 11.8268 numMergedOcc 0
32 mol 277 unq 1 iso 0 dist 9.91103 7.0603 3.39114 10.4297 5.46926 5.13913 5.77904 8.9682 6.92711 7.08227 numMergedOcc 0
33 mol 277 unq 1 iso 1 dist 9.91103 7.0603 3.39114 5.77904 8.9682 6.92711 10.4297 5.46926 5.13913 7.08227 numMergedOcc 0
34 mol 277 unq 2 iso 0 dist 7.0603 9.91103 3.39114 10.4297 5.13913 5.46926 5.77904 6.92711 8.9682 7.08227 numMergedOcc 0
35 mol 277 unq 2 iso 1 dist 7.0603 9.91103 3.39114 5.77904 6.92711 8.9682 10.4297 5.13913 5.46926 7.08227 numMergedOcc 0
