0 mol 10 unq 0 iso 0 dist 8.33546 9.59744 8.12738 11.5624 13.87 6.47424 4.17235 6.74091 8.44792 11.9429 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 6.76604 7.18716 4.0384 6.74364 9.63364 7.324 6.74307 5.61893 4.64234 5.34782 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 8.19721 6.51901 3.70802 6.8519 11.6607 9.1926 10.1564 10.7642 7.25138 10.5761 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 6.84323 6.51901 3.66673 6.8519 7.24768 9.1926 10.1564 9.3024 7.25138 10.5761 numMergedOcc 0
4 mol 62 unq 2 iso 0 dist 7.24768 9.1926 3.66673 6.8519 6.84323 6.51901 10.5761 9.3024 7.25138 10.1564 numMergedOcc 0
5 mol 90 unq 0 iso 0 dist 9.93577 8.17454 10.526 7.28669 13.0323 6.02596 10.1669 15.7056 6.10053 4.14427 numMergedOcc 0
6 mol 90 unq 1 iso 0 dist 7.38568 6.02596 4.66066 7.28669 8.6767 8.17454 4.14427 9.29411 6.10053 10.1669 numMergedOcc 0
7 mol 90 unq 2 iso 0 dist 8.6767 8.17454 4.66066 7.28669 7.38568 6.02596 10.1669 9.29411 6.10053 4.14427 numMergedOcc 0
8 mol 176 unq 0 iso 0 dist 6.21825 8.90797 10.5042 6.17921 11.9375 8.5107 15.7575 18.1647 9.09554 12.2988 numMergedOcc 0
9 mol 283 unq 0 iso 0 dist 9.74822 7.17276 9.8348 6.13301 11.9632 9.82274 5.70683 13.4669 8.85163 11.2468 numMergedOcc 0
10 mol 287 unq 0 iso 0 dist 5.06731 6.05363 3.76412 12.9333 12.4395 9.03468 11.8278 12.3269 8.71974 6.1412 numMergedOcc 0
11 mol 287 unq 1 iso 0 dist 5.06731 6.05363 3.76412 12.9333 12.4395 9.03468 4.22529 8.19213 8.82649 13.2279 numMergedOcc 0
12 mol 287 unq 2 iso 0 dist 5.06731 6.05363 3.76412 12.9333 12.4395 9.03468 8.19487 5.80664 7.35776 12.5251 numMergedOcc 0
13 mol 288 unq 0 iso 0 dist 5.06731 6.05363 3.76412 12.9333 12.4395 9.03468 11.8278 12.3269 8.71974 6.1412 numMergedOcc 0
14 mol 288 unq 1 iso 0 dist 5.06731 6.05363 3.76412 12.9333 12.4395 9.03468 4.22529 8.19213 8.82649 13.2279 numMergedOcc 0
15 mol 288 unq 2 iso 0 dist 5.06731 6.05363 3.76412 12.9333 12.4395 9.03468 8.19487 5.80664 7.35776 12.5251 numMergedOcc 0
16 mol 289 unq 0 iso 0 dist 5.06731 6.05363 3.76412 12.9333 12.4395 9.03468 11.8278 12.3269 8.71974 6.1412 numMergedOcc 0
17 mol 289 unq 1 iso 0 dist 5.06731 6.05363 3.76412 12.9333 12.4395 9.03468 4.22529 8.19213 8.82649 13.2279 numMergedOcc 0
18 mol 289 unq 2 iso 0 dist 5.06731 6.05363 3.76412 12.9333 12.4395 9.03468 8.19487 5.80664 7.35776 12.5251 numMergedOcc 0
19 mol 294 unq 0 iso 0 dist 8.63523 6.44588 9.96893 5.89 11.0917 5.18334 9.32276 13.8444 7.48987 11.4279 numMergedOcc 0
