0 mol 36 unq 0 iso 0 dist 4.32337 6.78857 4.28628 5.19721 6.29647 5.79779 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 5.63207 9.2958 6.18681 7.38819 9.58938 14.6383 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 8.71324 8.85601 13.5004 7.70414 9.10915 13.143 numMergedOcc 0
3 mol 64 unq 1 iso 0 dist 8.71324 8.85601 13.5004 5.89729 7.02352 14.1712 numMergedOcc 0
4 mol 64 unq 2 iso 0 dist 9.5663 8.85601 11.569 7.70414 5.54343 13.143 numMergedOcc 0
5 mol 83 unq 0 iso 0 dist 9.48319 7.88265 8.73538 5.88392 7.77558 11.4206 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 5.84349 8.6356 7.78168 4.16047 8.26838 11.8859 numMergedOcc 0
7 mol 102 unq 0 iso 0 dist 6.7095 9.00369 6.04036 5.26061 7.48277 10.6142 numMergedOcc 0
8 mol 102 unq 1 iso 0 dist 6.7095 9.00369 6.04036 8.90571 9.0361 5.54256 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 6.79014 8.56016 5.72803 5.23924 5.97879 9.20432 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 8.65807 6.90456 7.40105 6.73179 7.21902 10.1588 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 8.42226 9.6283 10.2597 9.40374 7.45401 14.4322 numMergedOcc 0
12 mol 189 unq 0 iso 0 dist 8.01521 8.49359 9.15913 5.56399 8.57361 12.2245 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 7.53036 8.42431 14.3699 4.22704 5.79186 8.65714 numMergedOcc 0
14 mol 214 unq 0 iso 0 dist 7.24175 7.93054 9.84398 4.7088 9.4835 12.594 numMergedOcc 0
15 mol 241 unq 0 iso 0 dist 7.16232 7.65636 11.2023 5.3674 6.40592 10.0267 numMergedOcc 0
16 mol 250 unq 0 iso 0 dist 5.97672 6.83662 5.66551 6.15778 8.21206 10.7288 numMergedOcc 0
17 mol 261 unq 0 iso 0 dist 6.93654 8.55479 4.0136 6.39263 8.50313 8.24356 numMergedOcc 0
18 mol 261 unq 1 iso 0 dist 9.66298 8.55479 4.30068 6.39263 7.6414 8.24356 numMergedOcc 0
