0 mol 24 unq 0 iso 0 dist 5.47982 9.921 9.69752 14.465 11.9395 8.00171 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 5.47982 11.3314 9.36461 14.465 11.9395 6.72323 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 4.87192 3.4435 4.90592 10.0903 10.0715 6.72323 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 5.81836 4.27162 6.74848 8.35396 5.45023 6.56527 numMergedOcc 0
4 mol 30 unq 0 iso 0 dist 9.29609 14.3828 6.55815 14.3145 5.60789 7.14464 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 5.01135 5.68596 7.59316 5.78969 4.16161 8.29857 numMergedOcc 0
6 mol 48 unq 1 iso 0 dist 5.20384 5.69576 7.51285 5.7898 4.20245 8.19993 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 9.22853 4.10173 6.48232 11.3716 7.86177 8.87464 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 6.00564 4.58085 8.70863 10.7986 8.31077 9.66222 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 8.40501 4.04076 7.39179 12.9364 13.0644 9.60622 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 8.40501 4.04076 7.39179 13.4884 9.98219 9.91054 numMergedOcc 0
11 mol 92 unq 2 iso 0 dist 9.82156 13.3756 7.39179 21.5683 13.0644 9.60622 numMergedOcc 0
12 mol 92 unq 3 iso 0 dist 9.82156 13.3756 7.39179 18.5812 9.98219 9.91054 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 7.7186 11.7528 9.9151 10.7404 4.99495 7.20249 numMergedOcc 0
14 mol 131 unq 0 iso 0 dist 8.34503 5.06665 5.39061 9.66687 5.67023 5.87084 numMergedOcc 0
15 mol 131 unq 1 iso 0 dist 5.70499 7.7998 5.39061 9.68242 5.67023 5.87084 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 7.39369 8.10654 5.68348 12.8521 7.50057 6.38324 numMergedOcc 0
17 mol 194 unq 1 iso 0 dist 7.39369 8.10654 5.68348 10.4112 5.92931 6.1886 numMergedOcc 0
18 mol 225 unq 0 iso 0 dist 9.18343 6.88681 9.23935 7.93342 8.98957 8.37739 numMergedOcc 0
19 mol 225 unq 1 iso 0 dist 9.18343 4.55231 7.77552 7.93342 8.98957 9.47237 numMergedOcc 0
20 mol 237 unq 0 iso 0 dist 8.32964 5.31202 5.06628 7.3216 5.90415 8.10254 numMergedOcc 0
