0 mol 13 unq 0 iso 0 dist 9.18487 6.54276 7.98465 7.71544 4.14738 4.43066 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.62693 5.23054 5.84066 8.6112 6.66387 9.63803 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.97117 12.2008 9.96121 12.5689 11.7823 9.90986 numMergedOcc 0
3 mol 41 unq 0 iso 0 dist 8.91418 9.00425 7.29079 9.59131 5.14132 8.0072 numMergedOcc 0
4 mol 41 unq 1 iso 0 dist 6.0961 12.6048 7.29079 10.2426 5.14132 8.0072 numMergedOcc 0
5 mol 78 unq 0 iso 0 dist 9.15288 7.72904 5.47706 11.6586 10.1263 7.32064 numMergedOcc 0
6 mol 78 unq 1 iso 0 dist 9.15288 7.72904 5.47706 10.9242 6.88255 4.62314 numMergedOcc 0
7 mol 78 unq 2 iso 0 dist 9.15288 9.64221 8.07568 11.6586 10.1263 5.85007 numMergedOcc 0
8 mol 78 unq 3 iso 0 dist 9.15288 9.64221 8.07568 10.9242 6.88255 6.35234 numMergedOcc 0
9 mol 78 unq 4 iso 0 dist 9.4909 11.0011 5.47706 17.923 10.1263 7.32064 numMergedOcc 0
10 mol 78 unq 5 iso 0 dist 9.4909 11.0011 5.47706 15.0238 6.88255 4.62314 numMergedOcc 0
11 mol 78 unq 6 iso 0 dist 9.4909 16.0481 8.07568 17.923 10.1263 5.85007 numMergedOcc 0
12 mol 78 unq 7 iso 0 dist 9.4909 16.0481 8.07568 15.0238 6.88255 6.35234 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 8.95838 5.99531 6.55202 11.3476 6.02826 5.90003 numMergedOcc 0
14 mol 119 unq 1 iso 0 dist 9.47892 13.9667 6.55202 11.8884 6.02826 5.90003 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 6.73897 3.75291 8.50705 8.64946 6.11049 9.76097 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 7.74744 10.7383 7.54341 10.5019 5.65619 5.56446 numMergedOcc 0
17 mol 155 unq 0 iso 0 dist 7.50392 5.68679 7.29911 12.165 8.63858 7.25009 numMergedOcc 0
18 mol 155 unq 1 iso 0 dist 8.02593 5.05961 5.36254 6.91762 4.40049 7.25009 numMergedOcc 0
19 mol 155 unq 2 iso 0 dist 8.77391 5.68679 5.36254 12.165 4.40049 7.25009 numMergedOcc 0
20 mol 197 unq 0 iso 0 dist 8.32685 15.7632 9.27218 10.1509 4.40086 6.0033 numMergedOcc 0
21 mol 197 unq 1 iso 0 dist 6.74777 15.6628 9.27218 9.89359 4.40086 6.0033 numMergedOcc 0
22 mol 197 unq 2 iso 0 dist 9.62514 18.7224 9.27218 13.4495 4.40086 6.0033 numMergedOcc 0
23 mol 233 unq 0 iso 0 dist 7.83363 4.98419 8.24424 7.74693 5.3674 8.7831 numMergedOcc 0
24 mol 233 unq 1 iso 0 dist 7.83363 7.08719 7.0942 7.74693 5.3674 9.61071 numMergedOcc 0
25 mol 233 unq 2 iso 0 dist 7.83363 10.7478 6.01775 7.74693 5.3674 7.1229 numMergedOcc 0
26 mol 233 unq 3 iso 0 dist 7.83363 10.7478 6.01775 16.9685 9.76593 9.55705 numMergedOcc 0
27 mol 238 unq 0 iso 0 dist 9.46582 5.17342 7.39547 9.51177 13.1765 6.96382 numMergedOcc 0
28 mol 238 unq 1 iso 0 dist 6.24435 11.7967 8.69525 10.0444 4.81145 9.99194 numMergedOcc 0
29 mol 259 unq 0 iso 0 dist 9.53092 12.9171 6.23661 13.3981 4.09442 4.95855 numMergedOcc 0
