0 mol 12 unq 0 iso 0 dist 6.05244 9.23849 7.4036 5.92892 5.76024 7.00079 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 6.05244 9.23849 7.4036 4.80294 7.92714 6.50215 numMergedOcc 0
2 mol 12 unq 2 iso 0 dist 6.05244 9.23849 7.4036 10.6891 8.47217 12.5814 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 8.69142 6.19189 7.89222 13.7478 6.93197 10.7484 numMergedOcc 0
4 mol 26 unq 1 iso 0 dist 9.01993 5.32341 9.53735 11.194 7.35861 12.3478 numMergedOcc 0
5 mol 26 unq 2 iso 0 dist 9.01993 17.2813 9.34599 11.194 7.35861 13.7277 numMergedOcc 0
6 mol 26 unq 3 iso 0 dist 8.43523 16.2881 7.89222 11.2171 6.93197 10.7484 numMergedOcc 0
7 mol 46 unq 0 iso 0 dist 8.12513 7.71151 8.5377 5.62202 8.0543 4.03395 numMergedOcc 0
8 mol 46 unq 1 iso 0 dist 6.9762 10.4607 8.5377 10.5748 8.0543 4.03395 numMergedOcc 0
9 mol 68 unq 0 iso 0 dist 6.27321 9.73424 7.3797 11.3732 6.74766 5.42651 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 5.21813 12.3905 7.43804 6.3915 7.36769 13.8217 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 5.21813 12.3905 7.43804 5.081 6.88901 12.9299 numMergedOcc 0
12 mol 98 unq 2 iso 0 dist 7.89276 6.32557 7.43804 11.0602 7.36769 13.8217 numMergedOcc 0
13 mol 98 unq 3 iso 0 dist 7.89276 6.32557 7.43804 14.1992 6.88901 12.9299 numMergedOcc 0
14 mol 112 unq 0 iso 0 dist 9.86487 6.68479 6.73172 11.57 7.80873 12.4858 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 9.29665 15.3512 9.32254 5.5502 6.84835 10.4629 numMergedOcc 0
16 mol 133 unq 1 iso 0 dist 9.29665 15.3512 9.32254 8.24649 8.42748 13.7961 numMergedOcc 0
17 mol 133 unq 2 iso 0 dist 5.08086 11.3977 9.32254 9.91819 6.84835 10.4629 numMergedOcc 0
18 mol 133 unq 3 iso 0 dist 5.08086 11.3977 9.32254 5.16948 8.42748 13.7961 numMergedOcc 0
19 mol 156 unq 0 iso 0 dist 5.42285 5.24063 6.97467 13.6106 8.21184 14.0762 numMergedOcc 0
20 mol 156 unq 1 iso 0 dist 5.42285 5.24063 6.97467 10.3208 5.9976 12.9439 numMergedOcc 0
21 mol 192 unq 0 iso 0 dist 8.25221 5.85988 7.27051 11.3395 8.26288 13.0844 numMergedOcc 0
22 mol 192 unq 1 iso 0 dist 8.25221 5.85988 7.27051 8.47522 6.60053 5.76622 numMergedOcc 0
23 mol 192 unq 2 iso 0 dist 6.64416 5.85988 7.35424 8.47522 9.36796 5.76622 numMergedOcc 0
24 mol 256 unq 0 iso 0 dist 5.58036 8.14283 8.95444 10.8477 6.33496 9.21273 numMergedOcc 0
25 mol 256 unq 1 iso 0 dist 5.58036 8.14283 8.95444 9.95403 6.00636 7.94816 numMergedOcc 0
26 mol 256 unq 2 iso 0 dist 5.58036 8.14283 8.95444 7.21464 7.81448 9.60388 numMergedOcc 0
27 mol 256 unq 3 iso 0 dist 5.58036 8.14283 8.95444 10.4702 8.54499 10.878 numMergedOcc 0
28 mol 256 unq 4 iso 0 dist 5.58036 6.16593 7.53508 10.8477 6.33496 11.5159 numMergedOcc 0
29 mol 256 unq 5 iso 0 dist 5.58036 6.16593 7.53508 9.95403 6.00636 12.9357 numMergedOcc 0
30 mol 256 unq 6 iso 0 dist 5.58036 6.16593 7.53508 7.21464 7.81448 4.03381 numMergedOcc 0
31 mol 256 unq 7 iso 0 dist 5.58036 6.16593 7.53508 10.4702 8.54499 7.45598 numMergedOcc 0
32 mol 287 unq 0 iso 0 dist 8.25538 5.76658 5.62568 7.64544 6.95912 5.48793 numMergedOcc 0
33 mol 287 unq 1 iso 0 dist 8.25538 16.0716 8.82948 7.64544 6.95912 10.7234 numMergedOcc 0
34 mol 288 unq 0 iso 0 dist 8.25538 5.76658 5.62568 7.64544 6.95912 5.48793 numMergedOcc 0
35 mol 288 unq 1 iso 0 dist 8.25538 16.0716 8.82948 7.64544 6.95912 10.7234 numMergedOcc 0
36 mol 289 unq 0 iso 0 dist 8.25538 5.76658 5.62568 7.64544 6.95912 5.48793 numMergedOcc 0
37 mol 289 unq 1 iso 0 dist 8.25538 16.0716 8.82948 7.64544 6.95912 10.7234 numMergedOcc 0
