0 mol 24 unq 0 iso 0 dist 6.48457 6.07553 10.8723 13.2846 7.18124 18.0368 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.48457 6.07553 10.8723 12.3897 6.47026 15.3977 numMergedOcc 0
2 mol 81 unq 0 iso 0 dist 6.4687 6.67147 4.0201 5.62545 7.15043 5.86142 numMergedOcc 0
3 mol 81 unq 1 iso 0 dist 6.4687 6.67147 4.0201 8.0518 5.70283 7.16741 numMergedOcc 0
4 mol 81 unq 2 iso 0 dist 6.67147 6.4687 4.0201 5.62545 5.86142 7.15043 numMergedOcc 0
5 mol 81 unq 3 iso 0 dist 6.67147 6.4687 4.0201 8.0518 7.16741 5.70283 numMergedOcc 0
6 mol 91 unq 0 iso 0 dist 8.99376 7.37948 4.05115 13.2837 5.16779 6.69121 numMergedOcc 0
7 mol 91 unq 1 iso 0 dist 7.37948 8.99376 4.05115 13.2837 6.69121 5.16779 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 8.69749 5.96576 4.14366 4.23405 9.24005 7.88846 numMergedOcc 0
9 mol 95 unq 1 iso 0 dist 5.96576 8.69749 4.14366 4.23405 7.88846 9.24005 numMergedOcc 0
10 mol 196 unq 0 iso 0 dist 6.11835 9.93668 4.06975 12.4987 8.94198 9.49159 numMergedOcc 0
11 mol 196 unq 1 iso 0 dist 9.93668 6.11835 4.06975 12.4987 9.49159 8.94198 numMergedOcc 0
12 mol 206 unq 0 iso 0 dist 9.73419 9.99824 14.3624 4.46135 9.24832 12.5218 numMergedOcc 0
13 mol 252 unq 0 iso 0 dist 7.48298 8.9483 4.31231 7.63636 9.84342 9.85159 numMergedOcc 0
14 mol 252 unq 1 iso 0 dist 7.48298 8.9483 4.31231 9.93981 8.63893 12.7353 numMergedOcc 0
15 mol 252 unq 2 iso 0 dist 8.9483 7.48298 4.31231 7.63636 9.85159 9.84342 numMergedOcc 0
16 mol 258 unq 0 iso 0 dist 7.98028 8.13183 9.36577 5.6683 8.27566 11.8903 numMergedOcc 0
17 mol 258 unq 1 iso 0 dist 5.8473 6.78929 9.36577 5.82277 8.27566 11.8903 numMergedOcc 0
18 mol 261 unq 0 iso 0 dist 9.00426 8.19348 4.01112 11.1348 7.8647 11.4483 numMergedOcc 0
19 mol 282 unq 0 iso 0 dist 8.76788 8.39723 3.9369 10.9871 7.89625 11.5265 numMergedOcc 0
20 mol 282 unq 1 iso 0 dist 8.76788 9.15503 14.9499 10.9871 7.89625 18.2579 numMergedOcc 0
