0 mol 4 unq 0 iso 0 dist 9.63758 10.7798 5.39008 6.88837 5.93454 6.00772 13.9132 4.46089 8.23852 9.88068 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.02869 15.4291 9.28571 17.2554 8.50044 9.62459 8.14952 8.4061 8.77648 14.7348 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 9.02869 15.4291 9.28571 4.91115 7.11539 15.3822 8.14952 8.4061 8.77648 10.4566 numMergedOcc 0
3 mol 7 unq 2 iso 0 dist 9.02869 14.326 8.05125 17.2554 8.50044 9.89662 13.7851 5.96526 6.0323 5.27578 numMergedOcc 0
4 mol 7 unq 3 iso 0 dist 9.02869 14.326 8.05125 4.91115 7.11539 10.7937 13.7851 5.96526 6.0323 10.0459 numMergedOcc 0
5 mol 124 unq 0 iso 0 dist 7.18976 9.2094 8.03603 10.1583 9.5436 4.26006 10.619 5.26643 5.61764 8.18186 numMergedOcc 0
6 mol 192 unq 0 iso 0 dist 6.2016 6.16078 5.83093 8.67274 8.29166 4.71967 7.30965 5.21255 7.72242 7.04366 numMergedOcc 0
7 mol 192 unq 1 iso 0 dist 6.2016 6.16078 5.83093 13.2917 8.14859 10.8213 7.30965 5.21255 7.72242 12.7509 numMergedOcc 0
8 mol 192 unq 2 iso 0 dist 6.2016 6.16078 5.83093 10.3343 5.62421 6.75301 7.30965 5.21255 7.72242 9.99783 numMergedOcc 0
9 mol 205 unq 0 iso 0 dist 5.86839 6.38518 6.02053 8.3451 9.37516 5.10109 12.9088 8.82544 8.21112 12.3761 numMergedOcc 0
10 mol 205 unq 1 iso 0 dist 5.86839 7.86936 7.41663 8.3451 9.37516 9.30128 12.9088 8.82544 7.06533 12.3761 numMergedOcc 0
11 mol 210 unq 0 iso 0 dist 8.05949 15.7959 8.94889 7.26107 9.24401 14.1634 18.427 12.3142 7.68078 19.4645 numMergedOcc 0
12 mol 210 unq 1 iso 0 dist 8.05949 15.7959 8.94889 7.26107 9.24401 14.1634 21.3893 13.7365 9.26518 18.8332 numMergedOcc 0
13 mol 224 unq 0 iso 0 dist 7.03925 6.1168 5.07376 5.93235 6.84722 4.07416 12.14 12.9085 9.92947 13.3398 numMergedOcc 0
14 mol 224 unq 1 iso 0 dist 7.03925 6.1168 5.07376 5.93235 6.84722 4.07416 7.47122 4.49347 7.46044 6.48885 numMergedOcc 0
15 mol 229 unq 0 iso 0 dist 6.28935 6.40216 9.42877 4.65019 8.70049 5.52902 10.0705 6.1732 8.86628 10.5182 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 8.86185 10.1043 7.80073 5.86546 8.87182 5.41296 6.00654 8.20191 8.78008 5.4347 numMergedOcc 0
17 mol 239 unq 1 iso 0 dist 8.86185 10.1043 7.80073 8.35939 5.95622 11.9194 6.00654 8.20191 8.78008 11.1516 numMergedOcc 0
18 mol 255 unq 0 iso 0 dist 7.57779 12.1115 7.16286 6.1967 8.88059 9.76349 10.6136 6.41518 6.61193 11.6989 numMergedOcc 0
19 mol 273 unq 0 iso 0 dist 5.78262 7.01631 7.84151 7.10817 9.16554 5.63899 13.861 10.402 9.36052 10.8281 numMergedOcc 0
20 mol 273 unq 1 iso 0 dist 5.78262 7.01631 7.84151 4.30863 8.83491 7.46111 13.861 10.402 9.36052 16.0175 numMergedOcc 0
21 mol 281 unq 0 iso 0 dist 4.75349 5.50235 6.47753 6.79166 7.85707 10.2741 11.697 10.2905 9.61122 17.6477 numMergedOcc 0
22 mol 281 unq 1 iso 0 dist 4.75349 9.84433 9.69744 6.79166 7.85707 13.7939 11.697 10.2905 9.95684 17.6477 numMergedOcc 0
