0 mol 24 unq 0 iso 0 dist 8.62284 13.719 9.36461 5.90981 9.69752 10.2653 21.4713 15.6099 7.85986 17.9863 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.62284 13.719 9.36461 5.90981 9.69752 10.2653 16.9823 12.5557 4.30252 12.7273 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.93364 6.45654 6.15801 11.9626 9.63403 6.47508 9.25424 4.06864 8.0991 8.80175 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 6.93364 6.45654 6.15801 11.9626 9.63403 6.47508 7.69101 5.9339 9.95093 12.1965 numMergedOcc 0
4 mol 34 unq 2 iso 0 dist 6.93364 6.45654 6.15801 14.1223 8.07314 9.89387 9.25424 4.06864 8.0991 9.26549 numMergedOcc 0
5 mol 34 unq 3 iso 0 dist 6.93364 6.45654 6.15801 14.1223 8.07314 9.89387 7.69101 5.9339 9.95093 13.3317 numMergedOcc 0
6 mol 34 unq 4 iso 0 dist 6.93364 11.9626 9.63403 6.45654 6.15801 6.47508 9.25424 4.06864 8.80175 8.0991 numMergedOcc 0
7 mol 34 unq 5 iso 0 dist 6.93364 11.9626 9.63403 14.1223 8.07314 10.4405 9.25424 4.06864 8.80175 9.26549 numMergedOcc 0
8 mol 34 unq 6 iso 0 dist 6.34821 7.35043 6.15801 13.4874 9.63403 6.47508 10.1225 4.06864 8.0991 8.80175 numMergedOcc 0
9 mol 34 unq 7 iso 0 dist 6.34821 7.35043 6.15801 13.4874 9.63403 6.47508 9.57665 5.9339 9.95093 12.1965 numMergedOcc 0
10 mol 34 unq 8 iso 0 dist 6.34821 7.35043 6.15801 12.0754 8.07314 9.89387 10.1225 4.06864 8.0991 9.26549 numMergedOcc 0
11 mol 34 unq 9 iso 0 dist 6.34821 7.35043 6.15801 12.0754 8.07314 9.89387 9.57665 5.9339 9.95093 13.3317 numMergedOcc 0
12 mol 34 unq 10 iso 0 dist 6.34821 13.4874 9.63403 7.35043 6.15801 6.47508 10.1225 4.06864 8.80175 8.0991 numMergedOcc 0
13 mol 34 unq 11 iso 0 dist 6.34821 13.4874 9.63403 12.0754 8.07314 10.4405 10.1225 4.06864 8.80175 9.26549 numMergedOcc 0
14 mol 44 unq 0 iso 0 dist 9.17518 9.05795 7.03307 6.37181 7.25707 5.25016 14.8466 10.0772 6.53981 9.14809 numMergedOcc 0
15 mol 44 unq 1 iso 0 dist 9.17518 6.37181 7.25707 9.05795 7.03307 5.25016 14.8466 10.0772 9.14809 6.53981 numMergedOcc 0
16 mol 44 unq 2 iso 0 dist 8.21833 11.814 7.03307 7.77924 7.25707 5.25016 15.4918 10.0772 6.53981 9.14809 numMergedOcc 0
17 mol 44 unq 3 iso 0 dist 8.21833 7.77924 7.25707 11.814 7.03307 5.25016 15.4918 10.0772 9.14809 6.53981 numMergedOcc 0
18 mol 92 unq 0 iso 0 dist 9.20197 10.7055 8.57827 6.91947 7.94453 11.7781 13.9294 5.19513 9.22418 12.7241 numMergedOcc 0
19 mol 131 unq 0 iso 0 dist 9.39683 10.8622 5.44303 12.6448 8.50562 5.37172 16.4794 9.93041 8.47526 13.2907 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 7.94153 4.35079 4.5271 5.34643 7.02575 6.68665 11.5528 6.50208 7.37629 12.4962 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 7.94153 4.35079 4.5271 5.34643 7.02575 6.68665 9.8337 6.3786 5.68985 11.8931 numMergedOcc 0
22 mol 186 unq 2 iso 0 dist 7.94153 5.34643 7.02575 4.35079 4.5271 6.68665 12.9302 8.54557 8.2241 11.9345 numMergedOcc 0
23 mol 193 unq 0 iso 0 dist 8.76185 5.97706 8.43187 10.8409 7.8141 12.9373 6.17074 5.43768 6.21262 11.7052 numMergedOcc 0
24 mol 237 unq 0 iso 0 dist 7.33613 9.55218 5.06628 4.7134 6.07878 8.65228 11.1579 5.20161 8.95332 10.5056 numMergedOcc 0
25 mol 237 unq 1 iso 0 dist 7.33613 9.55218 5.06628 6.42587 7.80422 6.60537 11.1579 5.20161 8.95332 12.9677 numMergedOcc 0
26 mol 282 unq 0 iso 0 dist 9.96468 9.09482 8.67489 6.18986 8.53065 12.6015 16.4557 10.6248 8.46115 18.2337 numMergedOcc 0
27 mol 282 unq 1 iso 0 dist 9.59817 6.21176 8.67489 10.2999 8.53065 12.6015 12.6077 10.6248 8.46115 18.2337 numMergedOcc 0
28 mol 285 unq 0 iso 0 dist 5.80415 4.39689 6.74142 7.87216 8.16947 3.87957 6.01404 8.03918 8.79261 10.6578 numMergedOcc 0
29 mol 285 unq 1 iso 0 dist 5.80415 4.39689 6.74142 7.87216 8.16947 3.87957 9.14377 11.1127 9.99125 10.4333 numMergedOcc 0
