0 mol 1 unq 0 iso 0 dist 9.56692 8.19374 8.56884 15.6677 9.01967 9.00903 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 8.23769 8.93161 8.33604 9.55823 8.27181 8.96553 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 8.11402 14.3932 9.16962 18.4976 11.887 8.34347 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 9.55469 6.98188 6.40841 13.5382 6.75888 7.32874 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 9.55469 8.66876 7.58407 12.6747 5.11205 6.64012 numMergedOcc 0
5 mol 58 unq 2 iso 0 dist 9.55469 5.69963 6.31428 12.6747 5.11205 9.4099 numMergedOcc 0
6 mol 58 unq 3 iso 0 dist 9.55469 5.69963 6.31428 13.5382 6.75888 9.55426 numMergedOcc 0
7 mol 58 unq 4 iso 0 dist 5.99959 9.0406 6.40841 8.52969 6.75888 7.32874 numMergedOcc 0
8 mol 58 unq 5 iso 0 dist 5.99959 6.58144 7.58407 7.15486 5.11205 6.64012 numMergedOcc 0
9 mol 58 unq 6 iso 0 dist 5.99959 4.98107 6.31428 7.15486 5.11205 9.4099 numMergedOcc 0
10 mol 58 unq 7 iso 0 dist 5.99959 4.98107 6.31428 8.52969 6.75888 9.55426 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 6.41059 9.79245 7.76729 11.3667 10.7942 9.33865 numMergedOcc 0
12 mol 115 unq 1 iso 0 dist 6.41059 9.79245 7.76729 14.0167 10.9739 5.83991 numMergedOcc 0
13 mol 115 unq 2 iso 0 dist 6.53104 10.1501 7.64585 11.1807 10.2377 9.33865 numMergedOcc 0
14 mol 115 unq 3 iso 0 dist 6.53104 10.1501 7.64585 14.5485 10.8939 6.11741 numMergedOcc 0
15 mol 117 unq 0 iso 0 dist 9.08874 7.07738 6.62561 16.0334 11.3679 9.84395 numMergedOcc 0
16 mol 117 unq 1 iso 0 dist 9.08874 7.07738 6.62561 11.2941 4.91401 7.90328 numMergedOcc 0
17 mol 117 unq 2 iso 0 dist 9.08874 4.8798 7.63616 11.2941 4.91401 7.83136 numMergedOcc 0
18 mol 119 unq 0 iso 0 dist 9.87854 16.5599 9.63176 17.9511 10.6679 8.73993 numMergedOcc 0
19 mol 119 unq 1 iso 0 dist 9.87854 5.72463 7.44174 14.5766 7.36192 9.87172 numMergedOcc 0
20 mol 119 unq 2 iso 0 dist 6.41992 5.78487 9.38288 13.4745 11.7228 9.87172 numMergedOcc 0
21 mol 119 unq 3 iso 0 dist 8.15125 5.78487 6.19042 13.4745 6.35763 9.87172 numMergedOcc 0
22 mol 119 unq 4 iso 0 dist 8.15125 13.4592 8.43904 17.2033 10.3457 6.18601 numMergedOcc 0
23 mol 156 unq 0 iso 0 dist 9.89595 6.52984 6.27641 7.80643 7.29758 7.44554 numMergedOcc 0
24 mol 156 unq 1 iso 0 dist 9.89595 6.52984 6.27641 12.2418 8.67156 8.94056 numMergedOcc 0
25 mol 156 unq 2 iso 0 dist 9.89595 6.52984 6.27641 10.8849 4.53931 9.83699 numMergedOcc 0
26 mol 192 unq 0 iso 0 dist 8.15486 5.64431 8.36822 9.05666 5.71262 5.59424 numMergedOcc 0
27 mol 197 unq 0 iso 0 dist 9.69154 17.1306 8.99696 17.4688 9.82139 8.56633 numMergedOcc 0
28 mol 197 unq 1 iso 0 dist 9.49122 15.7335 8.99696 16.6554 9.82139 8.56633 numMergedOcc 0
29 mol 214 unq 0 iso 0 dist 6.74861 6.75833 7.46831 6.83122 6.67959 8.85478 numMergedOcc 0
30 mol 238 unq 0 iso 0 dist 6.54661 10.4397 5.38637 9.82174 6.20606 6.57393 numMergedOcc 0
31 mol 238 unq 1 iso 0 dist 6.54661 10.1821 6.55759 9.2521 10.4664 7.31233 numMergedOcc 0
32 mol 238 unq 2 iso 0 dist 8.97261 10.1821 7.02475 9.2521 11.2717 7.31233 numMergedOcc 0
33 mol 256 unq 0 iso 0 dist 7.54244 9.41321 5.24676 11.0156 4.22352 8.29103 numMergedOcc 0
34 mol 264 unq 0 iso 0 dist 8.62569 16.3793 9.0012 18.0474 9.74238 9.361 numMergedOcc 0
35 mol 264 unq 1 iso 0 dist 8.62569 16.3793 9.0012 12.0293 5.12409 6.24356 numMergedOcc 0
36 mol 276 unq 0 iso 0 dist 7.3327 5.75852 8.76347 12.2355 7.54851 9.8993 numMergedOcc 0
37 mol 276 unq 1 iso 0 dist 7.3327 5.75852 8.76347 7.11272 6.4102 6.87396 numMergedOcc 0
38 mol 294 unq 0 iso 0 dist 5.81774 12.3326 9.03492 11.8926 6.17102 8.15665 numMergedOcc 0
