0 mol 30 unq 0 iso 0 dist 5.62002 5.64067 6.01834 5.61567 4.95244 4.60505 numMergedOcc 0
1 mol 30 unq 1 iso 0 dist 5.62002 5.64067 6.01834 8.46981 4.89458 6.70839 numMergedOcc 0
2 mol 41 unq 0 iso 0 dist 6.51139 8.19484 13.0657 8.0072 9.28138 7.20383 numMergedOcc 0
3 mol 41 unq 1 iso 0 dist 6.91278 8.19484 10.5378 8.0072 4.98483 7.20383 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 9.14072 9.15304 5.11472 5.41774 4.55422 4.30678 numMergedOcc 0
5 mol 53 unq 0 iso 0 dist 9.09831 9.23241 5.75171 9.33236 6.98415 11.4508 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 5.55798 5.69384 6.15669 8.59739 5.71097 4.4921 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 5.16531 7.56091 8.40757 6.53559 9.54936 3.91491 numMergedOcc 0
8 mol 129 unq 1 iso 0 dist 5.16531 7.56091 8.40757 7.90844 9.63929 9.18412 numMergedOcc 0
9 mol 130 unq 0 iso 0 dist 5.74058 7.39532 10.6107 5.82945 6.5713 6.76477 numMergedOcc 0
10 mol 130 unq 1 iso 0 dist 5.74058 6.62468 6.00932 5.82945 6.5713 10.6057 numMergedOcc 0
11 mol 226 unq 0 iso 0 dist 9.03261 6.62391 5.70083 9.71835 7.37944 7.01099 numMergedOcc 0
12 mol 226 unq 1 iso 0 dist 7.67573 6.62391 5.19299 9.71835 6.30585 7.01099 numMergedOcc 0
13 mol 232 unq 0 iso 0 dist 9.84479 9.49955 11.6745 9.85909 14.8057 14.4073 numMergedOcc 0
14 mol 232 unq 1 iso 0 dist 9.84479 7.03236 15.5279 9.85909 14.8057 12.7174 numMergedOcc 0
15 mol 232 unq 2 iso 0 dist 9.82645 9.49955 13.2376 9.85909 15.8965 14.4073 numMergedOcc 0
16 mol 232 unq 3 iso 0 dist 9.82645 7.03236 5.08257 9.85909 15.8965 12.7174 numMergedOcc 0
17 mol 237 unq 0 iso 0 dist 9.88041 9.80232 8.22147 9.58403 10.5069 8.22549 numMergedOcc 0
18 mol 237 unq 1 iso 0 dist 9.88041 6.18606 10.449 9.58403 10.5069 4.12168 numMergedOcc 0
19 mol 285 unq 0 iso 0 dist 7.38536 6.89391 9.66411 8.69325 10.5146 10.0457 numMergedOcc 0
20 mol 285 unq 1 iso 0 dist 7.38536 6.89391 9.66411 5.09181 4.4744 8.05127 numMergedOcc 0
