0 mol 7 unq 0 iso 0 dist 9.8592 7.91041 9.67498 8.8255 6.73272 5.80034 numMergedOcc 0
1 mol 38 unq 0 iso 0 dist 6.56791 6.81855 5.86243 13.7712 10.6088 7.98333 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 9.5663 12.6498 6.08228 16.3938 7.26196 5.65519 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 6.57452 11.6815 9.22636 15.6557 10.6994 8.85511 numMergedOcc 0
4 mol 126 unq 0 iso 0 dist 9.40595 14.8513 7.25133 18.323 9.15449 9.50807 numMergedOcc 0
5 mol 165 unq 0 iso 0 dist 9.76113 10.2845 8.64349 15.2565 9.92656 6.35749 numMergedOcc 0
6 mol 178 unq 0 iso 0 dist 9.3355 5.50567 6.25455 10.899 6.49969 8.83252 numMergedOcc 0
7 mol 178 unq 1 iso 0 dist 9.3355 6.1397 8.14441 14.0307 7.45885 9.56963 numMergedOcc 0
8 mol 178 unq 2 iso 0 dist 9.3355 6.1397 8.14441 10.899 6.49969 5.95885 numMergedOcc 0
9 mol 189 unq 0 iso 0 dist 9.36549 12.9479 7.04604 19.1138 12.8515 9.57128 numMergedOcc 0
10 mol 239 unq 0 iso 0 dist 8.49961 13.8894 8.34832 11.1725 4.95913 7.76984 numMergedOcc 0
11 mol 254 unq 0 iso 0 dist 9.79826 11.8433 9.75152 18.8186 14.0901 7.80528 numMergedOcc 0
12 mol 266 unq 0 iso 0 dist 9.46926 11.7148 8.61786 13.8846 5.26607 7.87939 numMergedOcc 0
13 mol 280 unq 0 iso 0 dist 8.64546 16.0615 9.05509 16.8251 8.34793 6.30852 numMergedOcc 0
14 mol 280 unq 1 iso 0 dist 3.97964 10.5502 9.05509 10.9905 8.34793 6.30852 numMergedOcc 0
15 mol 285 unq 0 iso 0 dist 8.17214 14.6688 8.63954 10.4227 6.85219 7.72733 numMergedOcc 0
16 mol 285 unq 1 iso 0 dist 8.17214 8.64319 4.74716 10.4227 6.85219 7.2491 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 8.80626 10.6818 4.49185 13.3059 4.76371 4.28058 numMergedOcc 0
18 mol 287 unq 1 iso 0 dist 8.80626 10.6818 4.49185 19.5418 11.7948 9.59064 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 8.80626 10.6818 4.49185 13.3059 4.76371 4.28058 numMergedOcc 0
20 mol 288 unq 1 iso 0 dist 8.80626 10.6818 4.49185 19.5418 11.7948 9.59064 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 8.80626 10.6818 4.49185 13.3059 4.76371 4.28058 numMergedOcc 0
22 mol 289 unq 1 iso 0 dist 8.80626 10.6818 4.49185 19.5418 11.7948 9.59064 numMergedOcc 0
