0 mol 18 unq 0 iso 0 dist 8.17979 5.03451 4.96019 8.93027 12.6372 7.94376 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 9.48375 8.16102 16.7495 5.84177 14.1773 9.29273 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 6.85127 8.16102 12.314 5.84177 12.632 9.29273 numMergedOcc 0
3 mol 27 unq 2 iso 0 dist 8.58169 8.16102 6.16154 5.84177 12.7052 9.29273 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 5.72494 7.85115 11.4876 9.41836 12.9296 5.51053 numMergedOcc 0
5 mol 103 unq 1 iso 0 dist 8.70106 7.85115 11.2795 9.41836 10.0799 5.51053 numMergedOcc 0
6 mol 143 unq 0 iso 0 dist 9.76501 7.99127 7.57516 10.4027 13.9384 7.2932 numMergedOcc 0
7 mol 148 unq 0 iso 0 dist 8.60157 7.91749 3.54257 6.57631 6.86997 8.74878 numMergedOcc 0
8 mol 148 unq 1 iso 0 dist 6.72591 7.91749 8.03052 6.57631 11.5345 8.74878 numMergedOcc 0
9 mol 150 unq 0 iso 0 dist 8.59359 7.96309 3.59609 6.56068 6.79381 8.74018 numMergedOcc 0
10 mol 150 unq 1 iso 0 dist 6.80192 7.96309 8.06512 6.56068 11.5855 8.74018 numMergedOcc 0
11 mol 158 unq 0 iso 0 dist 6.45502 4.88625 5.34159 7.33177 8.07946 7.20362 numMergedOcc 0
12 mol 168 unq 0 iso 0 dist 9.88342 6.24232 9.69599 12.3252 13.5627 6.12453 numMergedOcc 0
13 mol 168 unq 1 iso 0 dist 9.88342 6.13116 7.91845 12.3252 13.5627 9.87447 numMergedOcc 0
14 mol 168 unq 2 iso 0 dist 9.58783 8.1953 16.4635 7.48749 12.4168 6.12453 numMergedOcc 0
15 mol 168 unq 3 iso 0 dist 9.58783 8.16253 17.6725 7.48749 12.4168 9.87447 numMergedOcc 0
16 mol 184 unq 0 iso 0 dist 9.0757 9.11936 7.551 5.71349 4.88303 9.62748 numMergedOcc 0
17 mol 184 unq 1 iso 0 dist 9.0757 8.20517 4.75805 5.71349 4.88303 5.12964 numMergedOcc 0
18 mol 184 unq 2 iso 0 dist 9.39563 9.15923 4.75805 12.9618 4.88303 5.12964 numMergedOcc 0
19 mol 184 unq 3 iso 0 dist 9.39563 7.79098 11.6574 6.2568 14.8421 7.02762 numMergedOcc 0
20 mol 184 unq 4 iso 0 dist 7.51045 6.03505 4.75805 8.54538 4.88303 5.12964 numMergedOcc 0
21 mol 184 unq 5 iso 0 dist 7.51045 6.30144 11.6574 9.41221 14.8421 7.02762 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 8.98221 7.93815 12.6927 13.1468 19.5782 8.2241 numMergedOcc 0
23 mol 198 unq 0 iso 0 dist 7.83611 7.48253 11.4181 6.42799 14.2415 8.78623 numMergedOcc 0
24 mol 214 unq 0 iso 0 dist 9.66533 7.81831 6.49466 10.2269 13.8459 8.41013 numMergedOcc 0
25 mol 282 unq 0 iso 0 dist 6.15396 8.36459 4.4471 5.73412 7.84236 8.46115 numMergedOcc 0
26 mol 282 unq 1 iso 0 dist 9.18964 8.36459 10.1631 5.73412 11.8833 8.46115 numMergedOcc 0
27 mol 287 unq 0 iso 0 dist 4.66252 8.08382 12.1302 10.1822 14.6971 8.58427 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 4.66252 8.08382 12.1302 10.1822 14.6971 8.58427 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 4.66252 8.08382 12.1302 10.1822 14.6971 8.58427 numMergedOcc 0
