0 mol 21 unq 0 iso 0 dist 8.38921 6.86154 6.08338 16.0937 10.8106 9.34916 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 6.13476 6.2425 5.02241 4.22514 5.65405 8.41365 numMergedOcc 0
2 mol 75 unq 0 iso 0 dist 8.96262 4.79472 6.33365 11.7521 8.72784 7.49283 numMergedOcc 0
3 mol 75 unq 1 iso 0 dist 8.64872 4.79472 5.15851 11.7521 9.14798 7.49283 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 7.63534 4.35757 8.97793 5.25083 6.71804 8.35595 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 7.63534 6.55474 8.19682 5.25083 6.71804 6.22513 numMergedOcc 0
6 mol 76 unq 2 iso 0 dist 8.51543 8.36307 6.21982 12.8013 5.49132 6.22513 numMergedOcc 0
7 mol 156 unq 0 iso 0 dist 9.25604 5.5355 6.88137 10.6276 5.22807 9.22228 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 9.09857 9.00192 8.31897 17.959 15.713 9.13913 numMergedOcc 0
9 mol 175 unq 0 iso 0 dist 7.94593 11.0605 9.31887 9.81978 10.5343 9.15536 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 7.15963 9.09192 6.94688 11.981 5.114 9.30874 numMergedOcc 0
11 mol 181 unq 1 iso 0 dist 7.15963 12.1848 6.71012 11.981 5.114 5.54873 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 6.20646 6.27504 5.90931 9.69695 5.43761 5.37579 numMergedOcc 0
13 mol 204 unq 1 iso 0 dist 6.73266 6.67807 5.90931 8.18287 5.43761 5.37579 numMergedOcc 0
14 mol 213 unq 0 iso 0 dist 7.22234 10.6066 6.0965 10.3913 5.97098 7.53384 numMergedOcc 0
15 mol 213 unq 1 iso 0 dist 5.86501 5.56276 6.0965 10.0147 5.97098 7.53384 numMergedOcc 0
16 mol 213 unq 2 iso 0 dist 9.1663 7.28957 4.26212 9.82428 7.02346 9.347 numMergedOcc 0
17 mol 224 unq 0 iso 0 dist 9.61379 4.53973 7.06793 11.9775 11.8217 9.97425 numMergedOcc 0
18 mol 224 unq 1 iso 0 dist 9.61379 4.53973 7.06793 11.6333 11.9904 8.39753 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 8.39522 10.4124 6.91569 12.547 6.53984 5.72415 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 6.51823 9.28896 6.77463 10.8049 12.3128 7.90344 numMergedOcc 0
21 mol 238 unq 2 iso 0 dist 6.51823 6.04481 7.2766 15.5617 13.5175 9.83326 numMergedOcc 0
22 mol 238 unq 3 iso 0 dist 6.51823 6.04481 7.2766 10.3753 7.17967 6.19514 numMergedOcc 0
23 mol 253 unq 0 iso 0 dist 9.86979 10.094 7.19465 14.8241 7.07333 6.52138 numMergedOcc 0
24 mol 257 unq 0 iso 0 dist 8.95261 9.63067 7.14834 10.675 6.64096 7.48361 numMergedOcc 0
25 mol 257 unq 1 iso 0 dist 7.80336 5.47761 7.14834 8.5835 6.64096 7.48361 numMergedOcc 0
26 mol 259 unq 0 iso 0 dist 8.69345 13.2072 7.50578 21.1416 15.6082 9.418 numMergedOcc 0
27 mol 259 unq 1 iso 0 dist 8.69345 13.2072 7.50578 18.7885 10.5525 8.10823 numMergedOcc 0
28 mol 284 unq 0 iso 0 dist 9.12551 10.7029 4.86729 11.726 5.87119 8.6173 numMergedOcc 0
