0 mol 24 unq 0 iso 0 dist 8.86116 6.60423 5.97304 11.6226 8.09311 10.8583 12.3058 4.79736 7.56164 7.77964 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 5.04899 6.6492 9.20601 6.47509 7.05196 12.8378 6.55597 4.69295 8.89681 8.07318 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 5.04899 6.6492 9.20601 6.47509 7.05196 12.8378 12.3944 11.6045 17.2422 7.44277 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 5.73819 8.60739 5.64171 5.07458 6.66407 7.24352 13.8936 11.4153 8.41793 9.50614 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 5.73819 8.60739 5.64171 5.07458 6.66407 7.24352 6.75943 4.96926 4.55347 8.34145 numMergedOcc 0
5 mol 43 unq 2 iso 0 dist 5.73819 8.44903 5.48048 4.96926 6.75943 7.15901 6.66407 5.07458 4.69849 8.34145 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 9.64443 6.61823 7.24315 5.31547 9.36001 6.98037 12.8197 6.77937 8.11408 9.99441 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 9.64443 6.49956 12.163 5.31547 9.36001 11.0654 12.8197 6.77937 15.5741 9.99441 numMergedOcc 0
8 mol 109 unq 0 iso 0 dist 8.69985 5.34214 9.14441 5.00433 8.52024 9.78192 7.07971 4.69373 6.8409 9.09348 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 5.83991 5.72642 6.4497 6.01673 6.24825 10.6602 9.42082 6.63111 10.5109 7.65564 numMergedOcc 0
10 mol 115 unq 1 iso 0 dist 6.11741 5.74857 6.08806 6.07067 6.39384 10.3973 10.0255 6.95773 10.6688 7.65564 numMergedOcc 0
11 mol 115 unq 2 iso 0 dist 7.88312 5.74857 7.21418 6.07067 9.42082 10.3973 10.0255 6.01673 10.6688 7.65564 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 8.94367 8.20836 9.4027 7.41373 9.33094 5.11043 7.21868 8.06642 4.935 8.62504 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 6.49416 5.53031 8.46636 12.3479 9.33094 15.5709 11.988 8.06642 15.9889 8.62504 numMergedOcc 0
14 mol 134 unq 2 iso 0 dist 9.86662 8.20836 5.12325 7.41373 8.69531 5.11043 7.21868 4.00092 4.935 8.62504 numMergedOcc 0
15 mol 143 unq 0 iso 0 dist 5.99315 8.41611 12.7056 4.78563 5.37047 13.1913 5.40637 7.39837 6.16103 9.29944 numMergedOcc 0
16 mol 143 unq 1 iso 0 dist 5.99315 7.63338 12.8872 4.78563 5.37047 10.6706 5.40637 7.39837 8.4697 9.29944 numMergedOcc 0
17 mol 143 unq 2 iso 0 dist 5.99315 9.03707 7.76364 4.78563 5.37047 10.8457 5.40637 7.39837 5.41614 9.29944 numMergedOcc 0
18 mol 143 unq 3 iso 0 dist 5.99315 7.25673 9.23795 4.78563 5.37047 8.612 5.40637 7.39837 6.78032 9.29944 numMergedOcc 0
19 mol 170 unq 0 iso 0 dist 9.76807 8.15099 7.72147 4.78249 9.51256 5.13268 10.7199 5.7304 8.5768 8.75024 numMergedOcc 0
20 mol 178 unq 0 iso 0 dist 6.69288 4.92088 10.1489 6.42973 7.06025 8.25282 9.79683 10.8974 7.323 7.86352 numMergedOcc 0
21 mol 227 unq 0 iso 0 dist 7.22101 8.03442 10.5813 5.0317 5.23634 9.43618 11.595 4.664 14.9695 8.85955 numMergedOcc 0
22 mol 227 unq 1 iso 0 dist 7.22101 8.03442 10.5813 5.0317 5.23634 9.43618 9.91384 4.1511 11.2819 6.09335 numMergedOcc 0
23 mol 227 unq 2 iso 0 dist 8.65997 8.03442 7.22396 5.0317 6.91318 9.43618 11.595 8.49509 14.9695 8.85955 numMergedOcc 0
24 mol 227 unq 3 iso 0 dist 8.65997 8.03442 7.22396 5.0317 6.91318 9.43618 9.91384 4.69247 11.2819 6.09335 numMergedOcc 0
25 mol 238 unq 0 iso 0 dist 7.31233 5.64181 7.83352 10.3162 9.12776 12.1568 10.1172 5.71717 11.4389 4.66186 numMergedOcc 0
26 mol 272 unq 0 iso 0 dist 8.48753 9.05222 6.59863 5.12237 6.44147 10.6235 10.3659 4.03396 8.1164 8.55539 numMergedOcc 0
