0 mol 16 unq 0 iso 0 dist 9.30471 10.3757 7.03948 16.6039 10.7015 6.58035 20.6348 17.3012 10.9633 8.41862 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 6.41045 10.26 6.20943 13.3505 7.67038 7.82528 16.5778 13.4721 14.7664 8.78293 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 6.41045 10.26 6.20943 13.3505 7.67038 7.82528 19.8589 14.6255 11.0033 8.23643 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 8.75668 4.97497 8.68586 9.64871 10.6748 9.54144 10.2974 13.3487 6.23335 9.80142 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 7.46657 6.14439 6.21982 14.209 10.2879 8.19682 9.88513 11.062 5.67347 8.97793 numMergedOcc 0
5 mol 127 unq 0 iso 0 dist 9.89053 5.24695 6.63981 12.3692 6.16471 7.34519 17.6041 11.7596 12.7129 8.59981 numMergedOcc 0
6 mol 127 unq 1 iso 0 dist 9.89053 5.24695 6.63981 12.8489 4.48524 8.58999 17.6041 11.7596 12.7129 7.66331 numMergedOcc 0
7 mol 155 unq 0 iso 0 dist 8.57712 6.6805 7.39644 12.9795 10.7616 7.36102 6.51504 11.5473 5.68272 9.38946 numMergedOcc 0
8 mol 155 unq 1 iso 0 dist 8.57712 11.3672 7.70572 15.3124 7.01918 8.65888 18.1205 12.0728 10.1369 9.87281 numMergedOcc 0
9 mol 155 unq 2 iso 0 dist 8.57712 11.3672 7.70572 15.3124 7.01918 8.65888 16.1194 10.6403 5.44147 8.27111 numMergedOcc 0
10 mol 227 unq 0 iso 0 dist 8.27093 6.92493 8.17891 9.02226 5.22356 6.95902 9.72888 13.4493 8.55671 9.62609 numMergedOcc 0
11 mol 234 unq 0 iso 0 dist 5.46736 10.024 6.25105 10.8568 5.88703 7.85175 14.9467 10.3388 5.32617 9.5707 numMergedOcc 0
12 mol 236 unq 0 iso 0 dist 7.87233 4.71339 5.34718 9.13551 7.28249 7.17676 11.3543 10.5713 7.88539 6.68463 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 8.6771 8.92747 9.90142 9.58767 5.40359 5.9216 10.8712 12.5477 4.83721 9.68513 numMergedOcc 0
14 mol 293 unq 0 iso 0 dist 5.44043 5.86908 8.56847 11.5814 10.9721 9.47908 10.4612 14.1253 7.08365 9.97212 numMergedOcc 0
15 mol 293 unq 1 iso 0 dist 9.25564 6.42397 8.56847 13.2949 10.9721 9.47908 13.1885 14.1253 7.08365 9.97212 numMergedOcc 0
