0 mol 0 unq 0 iso 0 dist 9.16606 6.94181 5.85361 5.47921 11.788 7.15528 12.2644 15.0946 9.46298 7.40865 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 8.40995 7.32392 4.77411 15.5277 12.4562 9.60499 11.9168 10.5878 8.43473 6.02702 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 7.62469 9.17086 5.39546 5.90113 10.0804 8.80331 11.9521 9.06608 6.18002 8.95682 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 6.29755 6.54183 5.58127 5.65405 9.89662 8.10861 8.60653 11.1253 5.99981 7.21717 numMergedOcc 0
4 mol 54 unq 1 iso 0 dist 7.4038 6.54183 5.54544 5.65405 11.7963 8.10861 8.60653 10.063 5.99981 7.21717 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 7.77128 9.70415 16.1373 5.46309 12.841 6.65721 5.67362 5.04866 13.5488 9.25641 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 6.7939 8.16299 7.80518 10.3774 7.23812 8.70481 14.1293 14.7042 15.3808 9.24757 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 6.85356 8.16299 11.6012 10.3774 10.396 8.70481 14.1293 15.7711 15.3808 9.24757 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 8.44695 8.27015 7.80518 12.6626 7.23812 8.70481 21.4221 14.7042 15.3808 9.24757 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 5.26536 8.05602 12.5137 12.0507 15.9063 5.08437 13.251 18.2407 7.06961 6.7117 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 5.26536 8.05602 12.5137 12.0339 17.163 6.10456 13.251 18.2407 7.06961 4.47349 numMergedOcc 0
11 mol 100 unq 0 iso 0 dist 8.09751 8.96916 12.7068 5.92158 9.27725 6.45675 12.1601 11.626 7.11701 7.38135 numMergedOcc 0
12 mol 100 unq 1 iso 0 dist 8.09751 5.70279 11.3776 5.92158 9.27725 7.47343 12.1601 11.626 11.2312 7.38135 numMergedOcc 0
13 mol 129 unq 0 iso 0 dist 7.26325 6.23966 5.12351 6.65856 6.42706 5.83384 15.008 13.0193 10.7293 9.36851 numMergedOcc 0
14 mol 129 unq 1 iso 0 dist 7.26325 6.23966 5.12351 6.65856 6.42706 5.83384 11.0726 8.03693 7.29399 4.97175 numMergedOcc 0
15 mol 131 unq 0 iso 0 dist 9.14809 9.33945 14.651 12.3624 19.6719 8.40312 12.7271 15.0939 7.7567 9.90168 numMergedOcc 0
16 mol 131 unq 1 iso 0 dist 6.45169 9.33945 7.47571 12.3624 14.1255 8.40312 12.7271 13.3682 7.7567 9.90168 numMergedOcc 0
17 mol 222 unq 0 iso 0 dist 7.99609 8.7419 4.81992 5.01062 7.73634 6.00706 13.4892 10.3035 7.75466 9.07471 numMergedOcc 0
18 mol 222 unq 1 iso 0 dist 7.99609 8.5834 9.69122 5.01062 7.73634 7.54212 13.4892 10.3035 13.3447 9.07471 numMergedOcc 0
