0 mol 5 unq 0 iso 0 dist 7.92988 10.1185 9.64713 4.05341 4.9568 7.08935 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 6.30807 5.8083 7.45133 9.29547 5.80534 8.78977 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 5.78968 6.52334 8.58588 3.86946 8.7531 9.02466 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 5.78968 6.52334 8.58588 10.4041 7.25138 9.92911 numMergedOcc 0
4 mol 88 unq 0 iso 0 dist 5.59846 4.05003 6.26491 6.02019 8.56269 3.13977 numMergedOcc 0
5 mol 88 unq 1 iso 0 dist 5.59846 4.05003 6.26491 9.17488 9.40699 9.8511 numMergedOcc 0
6 mol 93 unq 0 iso 0 dist 8.52947 8.7353 8.55124 10.8428 5.10693 7.41642 numMergedOcc 0
7 mol 93 unq 1 iso 0 dist 8.52947 8.7353 8.55124 12.1443 6.58814 6.51388 numMergedOcc 0
8 mol 93 unq 2 iso 0 dist 8.52947 8.7353 8.55124 6.46649 6.13459 10.4066 numMergedOcc 0
9 mol 93 unq 3 iso 0 dist 8.52947 8.7353 8.55124 7.18673 7.54391 7.0544 numMergedOcc 0
10 mol 93 unq 4 iso 0 dist 8.84466 13.0411 8.55124 13.6305 5.10693 7.41642 numMergedOcc 0
11 mol 93 unq 5 iso 0 dist 8.84466 13.0411 8.55124 14.1431 6.58814 6.51388 numMergedOcc 0
12 mol 93 unq 6 iso 0 dist 8.84466 13.0411 8.55124 3.99275 6.13459 10.4066 numMergedOcc 0
13 mol 93 unq 7 iso 0 dist 8.84466 13.0411 8.55124 6.46195 7.54391 7.0544 numMergedOcc 0
14 mol 113 unq 0 iso 0 dist 8.28452 10.03 9.15172 3.7042 7.08403 12.174 numMergedOcc 0
15 mol 113 unq 1 iso 0 dist 8.44004 3.97916 9.15172 12.5507 7.08403 12.174 numMergedOcc 0
16 mol 128 unq 0 iso 0 dist 8.98367 12.3372 9.74232 10.337 5.38983 5.13616 numMergedOcc 0
17 mol 244 unq 0 iso 0 dist 7.00974 12.6177 8.19381 8.83892 5.16859 5.2958 numMergedOcc 0
18 mol 244 unq 1 iso 0 dist 7.00974 12.6177 8.19381 6.49718 4.79207 7.02866 numMergedOcc 0
19 mol 244 unq 2 iso 0 dist 7.00974 11.5282 8.93421 8.83892 5.16859 11.2661 numMergedOcc 0
20 mol 244 unq 3 iso 0 dist 7.00974 11.5282 8.93421 6.49718 4.79207 13.4101 numMergedOcc 0
21 mol 244 unq 4 iso 0 dist 7.00974 12.6014 7.35657 8.83892 5.16859 7.64875 numMergedOcc 0
22 mol 244 unq 5 iso 0 dist 7.00974 12.6014 7.35657 6.49718 4.79207 11.5997 numMergedOcc 0
23 mol 244 unq 6 iso 0 dist 7.00974 5.30507 6.19605 8.83892 5.16859 9.20762 numMergedOcc 0
24 mol 244 unq 7 iso 0 dist 7.00974 5.30507 6.19605 6.49718 4.79207 9.06024 numMergedOcc 0
25 mol 247 unq 0 iso 0 dist 8.72346 4.89475 6.14554 9.41036 4.78189 4.90304 numMergedOcc 0
26 mol 247 unq 1 iso 0 dist 7.39069 11.9901 6.14554 11.1225 4.78189 4.90304 numMergedOcc 0
27 mol 259 unq 0 iso 0 dist 6.83706 8.59148 9.03983 3.94409 6.69951 5.5217 numMergedOcc 0
28 mol 294 unq 0 iso 0 dist 8.88961 7.5022 6.33332 11.7154 7.48987 7.0236 numMergedOcc 0
29 mol 294 unq 1 iso 0 dist 8.88961 7.5022 6.33332 9.30905 8.35637 3.65046 numMergedOcc 0
