0 mol 9 unq 0 iso 0 dist 5.99711 6.26276 5.60208 5.79505 9.3523 10.6897 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.46609 6.17217 5.66783 4.29919 9.5053 6.56527 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 8.95651 5.62309 8.0763 4.1125 9.05259 6.77241 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 8.95651 7.11438 12.2082 4.1125 9.05259 5.50508 numMergedOcc 0
4 mol 93 unq 0 iso 0 dist 8.42713 7.4518 14.7862 15.595 7.62611 22.1507 numMergedOcc 0
5 mol 93 unq 1 iso 0 dist 8.42713 9.1687 9.42916 15.595 7.62611 16.0808 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 5.82501 7.48533 8.66057 3.88006 7.42482 8.42878 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 6.1835 9.34823 9.20368 6.49348 7.12072 13.0074 numMergedOcc 0
8 mol 131 unq 0 iso 0 dist 5.33314 8.58172 4.65836 7.57827 8.92828 13.5414 numMergedOcc 0
9 mol 131 unq 1 iso 0 dist 5.33314 8.58172 4.65836 3.98821 5.56627 9.86751 numMergedOcc 0
10 mol 131 unq 2 iso 0 dist 5.33314 8.94585 7.42665 7.57827 8.92828 14.3023 numMergedOcc 0
11 mol 131 unq 3 iso 0 dist 5.33314 8.94585 7.42665 3.98821 5.56627 11.7902 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 9.19335 5.56565 5.61022 5.21047 7.82544 6.84835 numMergedOcc 0
13 mol 133 unq 1 iso 0 dist 9.19335 6.16862 9.07376 5.21047 7.82544 9.98436 numMergedOcc 0
14 mol 133 unq 2 iso 0 dist 8.5076 5.56565 5.71483 5.21047 6.18808 6.84835 numMergedOcc 0
15 mol 133 unq 3 iso 0 dist 8.5076 6.16862 9.78763 5.21047 6.18808 9.98436 numMergedOcc 0
16 mol 171 unq 0 iso 0 dist 7.68295 6.80086 9.56885 4.98945 8.1536 10.3989 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 9.91705 9.07527 6.12563 5.32186 9.26796 10.0737 numMergedOcc 0
18 mol 194 unq 0 iso 0 dist 7.47107 8.03512 8.15427 10.7677 5.68348 10.5479 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 5.31079 6.32097 3.95218 6.5238 6.51288 9.73541 numMergedOcc 0
20 mol 237 unq 0 iso 0 dist 8.06435 8.42502 6.26206 3.96327 5.6703 8.10254 numMergedOcc 0
21 mol 237 unq 1 iso 0 dist 8.06435 8.42502 6.26206 9.75157 8.72819 12.2998 numMergedOcc 0
22 mol 274 unq 0 iso 0 dist 7.71972 9.11072 13.2001 6.70266 7.79704 10.6742 numMergedOcc 0
23 mol 274 unq 1 iso 0 dist 7.71972 6.83113 4.45396 6.70266 7.79704 10.083 numMergedOcc 0
24 mol 274 unq 2 iso 0 dist 7.71972 9.44134 5.57372 6.70266 7.79704 7.75216 numMergedOcc 0
25 mol 274 unq 3 iso 0 dist 9.76049 9.11072 18.037 6.70266 9.39276 10.6742 numMergedOcc 0
26 mol 274 unq 4 iso 0 dist 9.76049 6.83113 10.4434 6.70266 9.39276 10.083 numMergedOcc 0
27 mol 274 unq 5 iso 0 dist 9.76049 9.44134 12.4711 6.70266 9.39276 7.75216 numMergedOcc 0
28 mol 274 unq 6 iso 0 dist 7.65671 9.02071 5.36428 4.36131 8.2997 6.88827 numMergedOcc 0
