0 mol 2 unq 0 iso 0 dist 8.66033 14.6076 6.52386 5.31104 9.74371 14.1164 10.294 9.53758 15.1719 14.7531 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 9.54324 9.8254 6.52386 9.97841 9.74371 14.1164 17.2357 9.53758 15.1719 14.7531 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 8.81871 9.2768 5.77374 16.368 8.0166 9.33944 14.5403 6.0323 9.30196 5.85668 numMergedOcc 0
3 mol 7 unq 1 iso 0 dist 9.71959 9.2768 8.57437 5.46848 9.67498 10.0257 14.2168 8.85869 13.63 10.2939 numMergedOcc 0
4 mol 7 unq 2 iso 0 dist 9.71959 9.2768 8.57437 16.368 9.32945 9.33944 14.2168 8.85869 13.63 15.279 numMergedOcc 0
5 mol 44 unq 0 iso 0 dist 4.52881 4.61354 7.85573 8.53077 8.23606 11.0282 7.26957 9.53901 10.1746 6.11297 numMergedOcc 0
6 mol 44 unq 1 iso 0 dist 4.52881 6.03595 6.21423 8.53077 8.23606 6.5318 7.26957 9.53901 9.23503 6.11297 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 8.91858 16.776 9.10386 12.7633 9.27355 7.53682 7.25937 8.40844 12.2435 6.13631 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 8.91858 16.776 9.10386 12.7633 9.27355 7.53682 12.1332 7.02351 14.2654 16.1129 numMergedOcc 0
9 mol 73 unq 2 iso 0 dist 8.91858 16.776 9.10386 12.7633 9.27355 7.53682 14.2641 8.66342 10.362 12.6081 numMergedOcc 0
10 mol 99 unq 0 iso 0 dist 6.24473 6.27172 5.33644 4.73115 6.81741 6.02095 5.77364 8.23566 5.36117 8.61334 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 9.91507 11.6041 9.49104 4.92832 5.33543 8.22726 3.94348 9.21999 12.0027 5.57607 numMergedOcc 0
12 mol 151 unq 0 iso 0 dist 8.20292 5.34678 5.89907 12.7974 8.40442 12.2991 8.90385 6.12385 4.39532 10.5699 numMergedOcc 0
13 mol 211 unq 0 iso 0 dist 8.47937 8.40497 7.38723 5.28889 9.8921 12.6613 12.3964 7.15386 5.45968 15.2751 numMergedOcc 0
14 mol 211 unq 1 iso 0 dist 8.47937 8.40497 7.38723 5.28889 9.8921 12.6613 15.0308 7.73993 9.04294 17.5039 numMergedOcc 0
15 mol 211 unq 2 iso 0 dist 8.47937 8.40497 7.38723 5.28889 9.8921 12.6613 14.8063 9.45365 9.3095 16.4954 numMergedOcc 0
16 mol 226 unq 0 iso 0 dist 9.29519 6.08918 8.10096 5.84124 7.20862 6.92911 15.0399 9.05082 12.8829 15.6116 numMergedOcc 0
17 mol 279 unq 0 iso 0 dist 8.85653 4.0145 9.71653 8.89193 8.57035 6.05412 8.44153 8.15805 10.6101 13.2374 numMergedOcc 0
