0 mol 10 unq 0 iso 0 dist 9.48775 13.0084 8.16906 14.2786 4.84364 8.7908 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 4.78749 4.30555 5.65754 5.42968 10.0962 8.25818 numMergedOcc 0
2 mol 78 unq 0 iso 0 dist 9.93275 9.62606 6.11101 15.2049 5.72585 9.07629 numMergedOcc 0
3 mol 78 unq 1 iso 0 dist 9.93275 9.62606 6.11101 10.9234 7.38398 8.61143 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 6.30598 13.7485 9.43839 17.984 14.6513 6.67137 numMergedOcc 0
5 mol 85 unq 1 iso 0 dist 6.30598 13.7485 9.43839 10.4888 4.43737 9.78707 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 7.29309 4.77009 9.45257 5.58102 7.22521 6.5816 numMergedOcc 0
7 mol 122 unq 0 iso 0 dist 6.44313 7.85654 4.821 10.7094 5.74569 8.565 numMergedOcc 0
8 mol 204 unq 0 iso 0 dist 6.58174 10.816 8.77524 10.2826 10.6524 8.32259 numMergedOcc 0
9 mol 204 unq 1 iso 0 dist 6.58174 10.816 8.77524 8.47283 9.88337 9.93489 numMergedOcc 0
10 mol 225 unq 0 iso 0 dist 8.33143 16.0567 7.78392 20.2037 13.4414 9.54529 numMergedOcc 0
11 mol 266 unq 0 iso 0 dist 6.20998 6.80038 7.36137 7.96613 12.2408 7.8598 numMergedOcc 0
12 mol 266 unq 1 iso 0 dist 6.20998 6.80038 7.36137 14.3456 13.1028 8.25286 numMergedOcc 0
13 mol 266 unq 2 iso 0 dist 6.20998 4.5731 4.95415 7.96613 12.2408 7.80711 numMergedOcc 0
14 mol 266 unq 3 iso 0 dist 6.20998 4.5731 4.95415 14.3456 13.1028 9.9965 numMergedOcc 0
15 mol 266 unq 4 iso 0 dist 8.78219 6.80038 6.83784 7.96613 5.34431 7.8598 numMergedOcc 0
16 mol 266 unq 5 iso 0 dist 8.78219 6.80038 6.83784 14.3456 8.39575 8.25286 numMergedOcc 0
17 mol 266 unq 6 iso 0 dist 8.78219 4.5731 6.38519 7.96613 5.34431 7.80711 numMergedOcc 0
18 mol 266 unq 7 iso 0 dist 8.78219 4.5731 6.38519 14.3456 8.39575 9.9965 numMergedOcc 0
19 mol 285 unq 0 iso 0 dist 4.49395 8.32005 4.95596 5.93983 4.57431 5.88958 numMergedOcc 0
20 mol 285 unq 1 iso 0 dist 4.49395 7.07384 6.3508 5.93983 4.57431 7.78121 numMergedOcc 0
