0 mol 25 unq 0 iso 0 dist 7.63928 6.17631 6.03987 9.78075 6.85556 5.68392 14.5752 11.8565 12.1471 6.69002 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 7.20538 6.93876 8.66265 3.63144 7.16773 6.63327 9.52763 7.91078 14.838 9.78973 numMergedOcc 0
2 mol 119 unq 0 iso 0 dist 6.18763 5.3154 6.18601 6.49348 8.00003 10.4376 9.44788 6.83988 12.1173 5.58734 numMergedOcc 0
3 mol 129 unq 0 iso 0 dist 6.38163 8.61575 9.61051 7.03404 6.28565 6.30169 11.6486 12.2044 15.594 9.86237 numMergedOcc 0
4 mol 129 unq 1 iso 0 dist 6.38163 10.0961 5.83384 7.03404 6.28565 4.55551 11.6486 12.2044 11.5151 9.86237 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 9.50322 5.37072 7.11802 16.7326 9.22232 16.0138 15.3661 6.80292 13.0521 5.80404 numMergedOcc 0
6 mol 143 unq 0 iso 0 dist 8.30654 11.3469 5.99315 11.6678 7.78652 6.48978 15.8299 11.2897 11.3921 5.75595 numMergedOcc 0
7 mol 227 unq 0 iso 0 dist 9.07872 9.9474 7.09863 4.21811 6.02296 6.35849 6.14732 13.552 14.5974 8.61546 numMergedOcc 0
8 mol 235 unq 0 iso 0 dist 9.11256 6.84447 5.4638 3.93066 9.55668 7.60081 10.1095 12.3562 11.5033 6.20377 numMergedOcc 0
9 mol 235 unq 1 iso 0 dist 7.08539 7.38431 5.4638 13.0408 9.55668 7.60081 13.871 12.3562 11.5033 6.20377 numMergedOcc 0
10 mol 249 unq 0 iso 0 dist 6.37672 9.07501 7.57994 4.20164 5.48118 10.7772 7.279 9.82483 15.3404 4.68783 numMergedOcc 0
11 mol 249 unq 1 iso 0 dist 6.37672 4.24014 6.18582 4.20164 5.48118 7.04666 7.279 9.82483 11.128 4.68783 numMergedOcc 0
12 mol 249 unq 2 iso 0 dist 8.94023 9.53929 7.57994 5.93404 5.48118 10.7772 8.43448 9.82483 15.3404 4.68783 numMergedOcc 0
13 mol 249 unq 3 iso 0 dist 8.94023 5.36989 6.18582 5.93404 5.48118 7.04666 8.43448 9.82483 11.128 4.68783 numMergedOcc 0
14 mol 259 unq 0 iso 0 dist 8.06771 6.64729 8.13497 5.61261 7.98231 8.41846 5.98006 5.71237 6.77279 9.69025 numMergedOcc 0
15 mol 259 unq 1 iso 0 dist 8.06771 9.79538 7.88519 5.61261 7.98231 8.81835 5.98006 5.71237 9.58006 9.69025 numMergedOcc 0
16 mol 259 unq 2 iso 0 dist 9.54857 15.3806 7.46176 8.74892 7.08526 8.81835 17.6082 11.8501 9.58006 9.69025 numMergedOcc 0
17 mol 264 unq 0 iso 0 dist 8.43858 10.2215 9.361 4.29482 7.16853 11.1431 13.3031 10.0289 16.8589 9.14393 numMergedOcc 0
18 mol 264 unq 1 iso 0 dist 8.43858 8.55312 6.24356 4.29482 7.16853 5.00209 13.3031 10.0289 6.75305 9.14393 numMergedOcc 0
19 mol 274 unq 0 iso 0 dist 9.71801 5.9882 7.56915 4.36131 8.52587 5.29529 10.9157 17.306 12.0331 9.02661 numMergedOcc 0
