0 mol 6 unq 0 iso 0 dist 8.4681 9.12748 9.48103 6.46784 9.11785 6.94663 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.10063 8.12171 10.5906 7.63824 11.4519 4.11146 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 9.66461 8.16033 8.91456 6.77802 5.29743 3.85506 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 8.81136 8.31952 12.4205 9.48328 8.75048 10.8889 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 8.17492 7.77386 7.8821 5.89846 5.04771 3.23074 numMergedOcc 0
5 mol 85 unq 0 iso 0 dist 6.27877 5.99046 5.25569 8.15861 6.90443 11.3242 numMergedOcc 0
6 mol 85 unq 1 iso 0 dist 6.27877 5.99046 5.25569 9.27814 12.641 8.44 numMergedOcc 0
7 mol 91 unq 0 iso 0 dist 8.01351 4.86532 12.671 7.09177 12.7678 5.21888 numMergedOcc 0
8 mol 91 unq 1 iso 0 dist 8.98201 4.86532 6.11478 7.09177 6.3531 5.21888 numMergedOcc 0
9 mol 91 unq 2 iso 0 dist 6.4026 4.86532 6.42704 7.09177 3.99798 5.21888 numMergedOcc 0
10 mol 93 unq 0 iso 0 dist 6.67776 7.24843 6.79091 8.23294 4.90515 5.01255 numMergedOcc 0
11 mol 93 unq 1 iso 0 dist 6.67776 7.24843 6.79091 8.2702 5.08254 9.11323 numMergedOcc 0
12 mol 93 unq 2 iso 0 dist 6.67776 7.63783 8.71469 8.23294 4.90515 8.98901 numMergedOcc 0
13 mol 93 unq 3 iso 0 dist 6.67776 7.63783 8.71469 8.2702 5.08254 8.52329 numMergedOcc 0
14 mol 109 unq 0 iso 0 dist 8.00416 6.45174 6.08127 5.81859 12.8398 9.63255 numMergedOcc 0
15 mol 109 unq 1 iso 0 dist 8.00416 8.46446 15.2262 5.81859 12.8398 4.0719 numMergedOcc 0
16 mol 109 unq 2 iso 0 dist 7.39303 8.82036 6.21014 6.40989 5.21343 4.8632 numMergedOcc 0
17 mol 130 unq 0 iso 0 dist 9.83243 5.65876 9.67391 7.50304 6.91242 3.90693 numMergedOcc 0
18 mol 130 unq 1 iso 0 dist 9.83243 9.13825 5.68124 7.50304 6.91242 4.86681 numMergedOcc 0
19 mol 184 unq 0 iso 0 dist 8.11014 9.13228 8.78943 7.42696 15.2747 12.8344 numMergedOcc 0
20 mol 184 unq 1 iso 0 dist 8.11014 9.13228 8.78943 5.86468 4.75805 6.04545 numMergedOcc 0
21 mol 184 unq 2 iso 0 dist 8.11014 9.13228 8.78943 8.73302 11.6574 4.12242 numMergedOcc 0
22 mol 193 unq 0 iso 0 dist 8.30095 6.77983 11.8686 7.73964 14.2741 5.96435 numMergedOcc 0
23 mol 193 unq 1 iso 0 dist 8.30095 7.06538 5.88692 7.73964 14.2741 12.8368 numMergedOcc 0
24 mol 218 unq 0 iso 0 dist 5.51354 8.88206 8.22785 9.08818 10.5477 5.34495 numMergedOcc 0
25 mol 218 unq 1 iso 0 dist 5.51354 8.88206 8.22785 8.5163 6.71795 8.27161 numMergedOcc 0
26 mol 255 unq 0 iso 0 dist 5.84157 8.33795 6.1967 8.66655 11.3884 7.93069 numMergedOcc 0
