0 mol 59 unq 0 iso 0 dist 6.34078 6.94351 5.29167 8.69574 5.66067 7.57153 numMergedOcc 0
1 mol 67 unq 0 iso 0 dist 6.23298 5.70192 5.52457 8.4702 11.6017 11.4786 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 6.59382 7.00606 4.98716 6.04223 7.41773 3.93337 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 6.71671 8.42487 4.95298 5.53454 5.59536 3.56771 numMergedOcc 0
4 mol 117 unq 0 iso 0 dist 6.81489 8.0578 9.30367 6.01857 5.11935 4.18875 numMergedOcc 0
5 mol 123 unq 0 iso 0 dist 9.28454 6.7201 4.57557 8.30974 5.58056 6.04079 numMergedOcc 0
6 mol 123 unq 1 iso 0 dist 7.97266 6.7201 7.07913 8.30974 10.0663 6.04079 numMergedOcc 0
7 mol 148 unq 0 iso 0 dist 6.60739 8.07915 6.94302 6.81449 3.56704 10.129 numMergedOcc 0
8 mol 148 unq 1 iso 0 dist 9.22427 8.07915 12.3565 6.81449 5.6048 10.129 numMergedOcc 0
9 mol 148 unq 2 iso 0 dist 5.55129 8.07915 5.58057 6.81449 8.33576 10.129 numMergedOcc 0
10 mol 150 unq 0 iso 0 dist 6.71763 7.97801 6.83379 6.87593 3.56413 9.97049 numMergedOcc 0
11 mol 150 unq 1 iso 0 dist 9.32504 7.97801 12.2713 6.87593 5.53516 9.97049 numMergedOcc 0
12 mol 150 unq 2 iso 0 dist 5.53778 7.97801 5.55906 6.87593 8.23832 9.97049 numMergedOcc 0
13 mol 151 unq 0 iso 0 dist 9.74969 8.00027 4.18547 6.12972 4.17025 4.0895 numMergedOcc 0
14 mol 183 unq 0 iso 0 dist 5.83335 7.42108 6.39381 7.16035 9.54202 8.87705 numMergedOcc 0
15 mol 183 unq 1 iso 0 dist 5.83335 7.42108 6.39381 6.2675 4.96829 4.56996 numMergedOcc 0
16 mol 183 unq 2 iso 0 dist 9.92635 7.42108 16.8061 7.16035 10.7786 8.87705 numMergedOcc 0
17 mol 183 unq 3 iso 0 dist 9.92635 7.42108 16.8061 6.2675 14.145 4.56996 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 9.71223 9.08641 14.6658 6.99587 5.56574 11.4777 numMergedOcc 0
19 mol 186 unq 1 iso 0 dist 9.71223 9.08641 14.6658 4.37577 7.76011 9.8669 numMergedOcc 0
20 mol 232 unq 0 iso 0 dist 7.99525 7.79085 5.30261 9.25334 3.68934 5.75889 numMergedOcc 0
21 mol 232 unq 1 iso 0 dist 9.20965 6.48753 5.30261 9.38205 3.68934 5.75889 numMergedOcc 0
22 mol 232 unq 2 iso 0 dist 9.20965 6.48753 5.30261 8.32831 13.1614 11.1335 numMergedOcc 0
23 mol 269 unq 0 iso 0 dist 7.97206 9.92223 7.20409 6.72096 4.41005 9.20524 numMergedOcc 0
24 mol 269 unq 1 iso 0 dist 7.97206 5.98602 4.52168 6.72096 4.41005 5.98901 numMergedOcc 0
25 mol 269 unq 2 iso 0 dist 7.1068 9.78238 4.52168 9.18157 4.41005 5.98901 numMergedOcc 0
26 mol 274 unq 0 iso 0 dist 8.26851 8.62431 4.05661 9.82713 13.8247 15.8795 numMergedOcc 0
27 mol 274 unq 1 iso 0 dist 8.14634 8.62431 7.47324 9.82713 9.90818 15.8795 numMergedOcc 0
