0 mol 19 unq 0 iso 0 dist 7.46208 8.43581 3.73148 4.73459 6.41656 5.72005 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.2004 5.02954 4.11146 7.19293 9.85784 9.58192 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 6.2004 5.02954 4.11146 5.56258 9.87996 9.69854 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 4.90592 9.65174 9.63925 8.10397 6.61696 13.302 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 4.90592 9.65174 9.63925 9.57743 5.80953 7.7447 numMergedOcc 0
5 mol 24 unq 4 iso 0 dist 9.36461 9.41655 14.1137 13.8334 6.61696 14.9684 numMergedOcc 0
6 mol 24 unq 5 iso 0 dist 9.36461 9.41655 14.1137 4.47891 5.80953 12.089 numMergedOcc 0
7 mol 24 unq 6 iso 0 dist 9.36461 6.803 13.4584 13.8334 6.61696 16.0986 numMergedOcc 0
8 mol 24 unq 7 iso 0 dist 9.36461 6.803 13.4584 4.47891 5.80953 10.4905 numMergedOcc 0
9 mol 24 unq 8 iso 0 dist 8.16324 9.65174 12.5427 5.11135 9.586 10.3921 numMergedOcc 0
10 mol 26 unq 0 iso 0 dist 9.5053 9.41425 8.58071 13.4114 6.7142 13.7053 numMergedOcc 0
11 mol 60 unq 0 iso 0 dist 4.65127 6.46718 3.99942 5.71764 6.63448 9.98904 numMergedOcc 0
12 mol 85 unq 0 iso 0 dist 8.70863 5.72961 11.5785 12.7386 5.05893 16.4531 numMergedOcc 0
13 mol 85 unq 1 iso 0 dist 8.70863 5.72961 11.5785 14.1999 5.71866 16.7975 numMergedOcc 0
14 mol 105 unq 0 iso 0 dist 7.09806 9.09664 9.73765 9.02856 7.77089 13.8628 numMergedOcc 0
15 mol 131 unq 0 iso 0 dist 5.39061 4.48699 4.94367 4.24991 7.75314 8.49847 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 9.78667 8.88454 3.80087 12.6553 7.42144 9.5889 numMergedOcc 0
17 mol 141 unq 1 iso 0 dist 9.78667 8.88454 3.80087 13.5035 6.27658 8.03978 numMergedOcc 0
18 mol 141 unq 2 iso 0 dist 8.47026 9.48581 3.80087 10.1588 7.42144 9.5889 numMergedOcc 0
19 mol 141 unq 3 iso 0 dist 8.47026 9.48581 3.80087 11.7454 6.27658 8.03978 numMergedOcc 0
20 mol 141 unq 4 iso 0 dist 6.73983 8.88454 3.80763 14.228 9.27009 10.0911 numMergedOcc 0
21 mol 141 unq 5 iso 0 dist 8.6387 9.48581 3.80763 14.0232 9.27009 10.0911 numMergedOcc 0
22 mol 141 unq 6 iso 0 dist 7.64956 8.88454 9.98068 8.48213 6.65731 14.3335 numMergedOcc 0
23 mol 194 unq 0 iso 0 dist 6.37788 5.13892 3.7326 5.28603 4.19371 4.45769 numMergedOcc 0
24 mol 194 unq 1 iso 0 dist 6.37788 5.13892 3.7326 10.7058 9.71015 8.99961 numMergedOcc 0
25 mol 194 unq 2 iso 0 dist 6.37788 5.78717 7.29209 5.28603 4.19371 5.89939 numMergedOcc 0
26 mol 194 unq 3 iso 0 dist 6.37788 5.78717 7.29209 10.7058 9.71015 8.18853 numMergedOcc 0
27 mol 194 unq 4 iso 0 dist 8.7028 8.2232 3.7326 11.0713 4.19371 4.45769 numMergedOcc 0
28 mol 194 unq 5 iso 0 dist 8.7028 8.2232 3.7326 16.9177 9.71015 8.99961 numMergedOcc 0
29 mol 210 unq 0 iso 0 dist 6.78579 8.83523 13.4242 6.75621 9.68477 14.4693 numMergedOcc 0
30 mol 252 unq 0 iso 0 dist 7.39391 8.38453 3.99887 4.34126 8.09509 9.81261 numMergedOcc 0
31 mol 260 unq 0 iso 0 dist 7.99521 4.64695 7.28821 11.362 6.75725 11.8771 numMergedOcc 0
32 mol 260 unq 1 iso 0 dist 7.99521 4.64695 7.28821 5.38958 9.31888 7.49606 numMergedOcc 0
33 mol 277 unq 0 iso 0 dist 7.85414 8.78893 12.1127 14.6871 9.26157 21.0741 numMergedOcc 0
