0 mol 10 unq 0 iso 0 dist 9.31452 8.44864 5.16967 4.87706 10.7108 9.43029 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.62527 8.99751 10.4631 13.4787 13.1071 9.36924 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 8.62527 9.44507 12.1978 8.43529 14.8899 6.7142 numMergedOcc 0
3 mol 55 unq 0 iso 0 dist 9.39738 6.66861 5.99401 6.89662 13.1865 8.70598 numMergedOcc 0
4 mol 55 unq 1 iso 0 dist 9.9421 6.72084 5.99401 3.74852 13.1865 8.70598 numMergedOcc 0
5 mol 93 unq 0 iso 0 dist 8.55124 7.4518 11.6667 3.91263 10.8509 7.28831 numMergedOcc 0
6 mol 93 unq 1 iso 0 dist 8.55124 9.1687 5.0847 3.91263 10.8509 9.71411 numMergedOcc 0
7 mol 112 unq 0 iso 0 dist 9.28645 5.42828 5.54999 3.61827 12.3351 8.72725 numMergedOcc 0
8 mol 112 unq 1 iso 0 dist 9.28645 5.42828 5.54999 3.78964 7.77418 6.11407 numMergedOcc 0
9 mol 129 unq 0 iso 0 dist 9.66828 9.86988 5.85167 4.45029 8.46972 6.34626 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 8.06644 5.49198 5.90151 5.19373 12.5115 7.83568 numMergedOcc 0
11 mol 160 unq 0 iso 0 dist 8.69583 8.50897 4.84936 9.09492 10.0119 6.41119 numMergedOcc 0
12 mol 160 unq 1 iso 0 dist 8.69583 8.50897 4.84936 12.5957 13.2019 9.08051 numMergedOcc 0
13 mol 162 unq 0 iso 0 dist 9.32658 8.88796 17.359 9.96226 18.5606 9.76044 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 7.04782 9.07527 14.9846 9.00952 15.4481 8.12266 numMergedOcc 0
15 mol 181 unq 1 iso 0 dist 7.04782 9.07527 14.9846 8.32063 14.4224 9.43306 numMergedOcc 0
16 mol 181 unq 2 iso 0 dist 7.04782 9.07527 14.9846 7.88733 12.2203 8.59681 numMergedOcc 0
17 mol 194 unq 0 iso 0 dist 9.08655 8.03512 8.39273 3.86206 9.26885 9.32959 numMergedOcc 0
18 mol 195 unq 0 iso 0 dist 9.39697 8.13947 6.45756 6.61517 10.6913 9.24936 numMergedOcc 0
19 mol 195 unq 1 iso 0 dist 4.86882 8.13947 5.65165 6.61517 5.66071 9.24936 numMergedOcc 0
20 mol 232 unq 0 iso 0 dist 8.21479 7.83422 8.15893 6.54593 11.8835 6.59036 numMergedOcc 0
21 mol 260 unq 0 iso 0 dist 6.23198 5.68717 6.93843 9.0549 10.8312 6.75725 numMergedOcc 0
22 mol 260 unq 1 iso 0 dist 6.23198 5.68717 6.93843 6.73886 10.9549 9.31888 numMergedOcc 0
23 mol 273 unq 0 iso 0 dist 5.75335 6.38341 5.63899 3.80794 9.29783 7.85836 numMergedOcc 0
24 mol 273 unq 1 iso 0 dist 5.75335 6.38341 5.63899 5.19474 8.28809 6.35532 numMergedOcc 0
25 mol 273 unq 2 iso 0 dist 5.75335 9.78826 7.46111 13.255 11.3096 5.61969 numMergedOcc 0
26 mol 273 unq 3 iso 0 dist 8.76527 6.38341 11.3048 3.80794 12.1337 7.85836 numMergedOcc 0
27 mol 273 unq 4 iso 0 dist 8.76527 6.38341 11.3048 5.19474 13.5107 6.35532 numMergedOcc 0
28 mol 273 unq 5 iso 0 dist 8.76527 9.78826 5.60451 13.255 11.2194 5.61969 numMergedOcc 0
29 mol 292 unq 0 iso 0 dist 9.86767 6.60049 6.28133 7.45665 12.8302 8.6233 numMergedOcc 0
