0 mol 28 unq 0 iso 0 dist 6.14086 6.46236 7.82759 6.82151 8.53424 12.7911 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 6.76158 9.86606 7.82759 4.3475 8.53424 12.7911 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 7.12713 8.18746 8.99393 4.64633 3.77542 6.95897 numMergedOcc 0
3 mol 46 unq 1 iso 0 dist 7.12713 8.18746 8.99393 13.8401 9.97314 12.41 numMergedOcc 0
4 mol 46 unq 2 iso 0 dist 8.13664 4.89975 7.23371 8.59614 3.77542 6.75911 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 9.80453 4.38483 7.32699 8.42234 9.05737 9.58381 numMergedOcc 0
6 mol 48 unq 1 iso 0 dist 9.80453 8.2379 6.45933 8.42234 9.05737 7.61744 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 5.91023 10.5613 5.85622 5.90092 6.5816 8.09756 numMergedOcc 0
8 mol 107 unq 0 iso 0 dist 4.99934 7.90448 9.4238 10.9097 8.88124 17.9309 numMergedOcc 0
9 mol 107 unq 1 iso 0 dist 4.99934 7.90448 9.4238 4.34186 8.19484 8.0395 numMergedOcc 0
10 mol 176 unq 0 iso 0 dist 6.32254 11.3492 9.95907 4.03856 8.65645 12.7022 numMergedOcc 0
11 mol 176 unq 1 iso 0 dist 6.32254 11.3492 9.95907 5.25264 6.85902 6.27598 numMergedOcc 0
12 mol 176 unq 2 iso 0 dist 8.89556 9.65515 9.95907 6.94233 8.65645 12.7022 numMergedOcc 0
13 mol 176 unq 3 iso 0 dist 8.89556 9.65515 9.95907 3.97245 6.85902 6.27598 numMergedOcc 0
14 mol 193 unq 0 iso 0 dist 9.28442 5.17567 6.10013 6.06113 8.30069 4.40965 numMergedOcc 0
15 mol 193 unq 1 iso 0 dist 9.28442 5.17567 6.10013 3.45561 8.83551 6.04442 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 9.3032 14.008 7.26295 12.2934 5.10542 3.64489 numMergedOcc 0
17 mol 194 unq 1 iso 0 dist 8.10451 13.2027 7.26295 11.2635 5.10542 3.64489 numMergedOcc 0
18 mol 194 unq 2 iso 0 dist 6.6747 13.2027 7.31316 11.2635 4.68722 3.64489 numMergedOcc 0
19 mol 194 unq 3 iso 0 dist 6.6747 13.2027 7.31316 10.5989 5.18325 9.00349 numMergedOcc 0
20 mol 194 unq 4 iso 0 dist 6.6747 4.71471 8.9865 11.2635 4.68722 13.481 numMergedOcc 0
21 mol 194 unq 5 iso 0 dist 6.6747 4.71471 8.9865 10.5989 5.18325 11.1547 numMergedOcc 0
22 mol 194 unq 6 iso 0 dist 6.28412 7.02856 7.31316 5.18799 4.68722 3.64489 numMergedOcc 0
23 mol 194 unq 7 iso 0 dist 6.28412 7.02856 7.31316 4.45047 5.18325 9.00349 numMergedOcc 0
24 mol 194 unq 8 iso 0 dist 6.28412 12.3079 8.9865 5.18799 4.68722 13.481 numMergedOcc 0
25 mol 194 unq 9 iso 0 dist 6.28412 12.3079 8.9865 4.45047 5.18325 11.1547 numMergedOcc 0
26 mol 243 unq 0 iso 0 dist 8.35328 5.52989 7.6142 6.56644 4.55853 3.64536 numMergedOcc 0
27 mol 260 unq 0 iso 0 dist 6.02628 5.42082 4.20369 5.30931 7.04263 5.76999 numMergedOcc 0
28 mol 291 unq 0 iso 0 dist 7.19577 5.29761 7.02207 4.24113 8.95881 9.16979 numMergedOcc 0
