0 mol 98 unq 0 iso 0 dist 6.98059 6.41735 6.62972 11.7234 8.53212 7.14031 numMergedOcc 0
1 mol 98 unq 1 iso 0 dist 5.63127 11.1359 6.62972 10.7041 8.53212 7.14031 numMergedOcc 0
2 mol 114 unq 0 iso 0 dist 8.56617 8.10825 7.42482 13.5548 8.66057 8.42878 numMergedOcc 0
3 mol 116 unq 0 iso 0 dist 7.8529 7.27315 8.79367 14.9681 12.2604 8.38606 numMergedOcc 0
4 mol 119 unq 0 iso 0 dist 9.69341 4.91693 9.9151 9.04937 4.99495 7.20249 numMergedOcc 0
5 mol 134 unq 0 iso 0 dist 5.10248 11.4949 9.30061 14.4533 14.2253 6.40575 numMergedOcc 0
6 mol 193 unq 0 iso 0 dist 9.07517 7.09749 7.8141 9.58736 3.98356 9.40801 numMergedOcc 0
7 mol 194 unq 0 iso 0 dist 8.26119 11.9617 5.68348 11.7399 7.50057 6.38324 numMergedOcc 0
8 mol 194 unq 1 iso 0 dist 8.26119 11.9617 5.68348 7.27978 5.92931 6.1886 numMergedOcc 0
9 mol 194 unq 2 iso 0 dist 9.10338 6.96419 5.68348 13.1523 7.50057 6.38324 numMergedOcc 0
10 mol 194 unq 3 iso 0 dist 9.10338 6.96419 5.68348 9.33397 5.92931 6.1886 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 5.43648 6.39762 6.51288 9.22885 3.95218 9.73541 numMergedOcc 0
12 mol 225 unq 0 iso 0 dist 7.55355 6.17371 9.23935 12.3425 8.98957 8.37739 numMergedOcc 0
13 mol 225 unq 1 iso 0 dist 7.55355 5.43186 7.77552 12.3425 8.98957 9.47237 numMergedOcc 0
14 mol 260 unq 0 iso 0 dist 8.09112 4.48112 7.99521 10.808 5.52447 9.32954 numMergedOcc 0
15 mol 260 unq 1 iso 0 dist 5.6002 5.72956 7.99521 7.23618 5.52447 9.32954 numMergedOcc 0
