0 mol 17 unq 0 iso 0 dist 9.38298 10.6611 7.96836 5.57445 7.34681 5.21083 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 5.84559 8.26254 7.96836 6.18212 7.34681 5.21083 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 9.29555 8.78005 8.53329 4.50335 9.32184 9.03693 numMergedOcc 0
3 mol 83 unq 0 iso 0 dist 9.55654 6.27475 7.6104 15.1565 7.2118 13.468 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 9.9259 6.05632 7.75977 7.88521 8.15664 10.7488 numMergedOcc 0
5 mol 99 unq 0 iso 0 dist 7.55765 6.43058 5.57391 10.8479 8.68674 4.73115 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 9.907 12.5299 7.68908 7.38372 7.66418 6.35861 numMergedOcc 0
7 mol 103 unq 1 iso 0 dist 9.907 12.5299 7.68908 9.52982 8.078 5.56761 numMergedOcc 0
8 mol 131 unq 0 iso 0 dist 8.32304 5.1971 8.98949 8.6975 6.08846 12.1136 numMergedOcc 0
9 mol 131 unq 1 iso 0 dist 8.32304 5.1971 8.98949 13.631 9.19171 15.0398 numMergedOcc 0
10 mol 212 unq 0 iso 0 dist 8.48834 10.2341 8.31372 6.03246 7.6819 5.30451 numMergedOcc 0
11 mol 212 unq 1 iso 0 dist 8.48834 10.2341 8.31372 10.3667 6.36102 4.71691 numMergedOcc 0
12 mol 239 unq 0 iso 0 dist 8.87704 15.2048 6.55222 11.2878 8.86185 13.0572 numMergedOcc 0
13 mol 239 unq 1 iso 0 dist 9.11375 5.85199 6.55222 10.978 8.86185 13.0572 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 6.95552 5.27451 7.32876 7.51285 8.57274 9.77666 numMergedOcc 0
15 mol 276 unq 0 iso 0 dist 7.64844 8.23967 7.86619 5.58105 7.60807 4.13053 numMergedOcc 0
16 mol 279 unq 0 iso 0 dist 9.90251 8.68289 8.12646 5.25707 7.83793 4.91933 numMergedOcc 0
