0 mol 65 unq 0 iso 0 dist 7.72373 5.42391 8.7647 10.8737 9.75927 8.52876 numMergedOcc 0
1 mol 71 unq 0 iso 0 dist 7.56624 4.49345 7.92957 14.9361 9.95096 12.3881 numMergedOcc 0
2 mol 71 unq 1 iso 0 dist 8.83594 14.2448 7.92957 7.15776 9.95096 12.3881 numMergedOcc 0
3 mol 95 unq 0 iso 0 dist 8.98691 6.17996 9.11115 7.08612 8.27456 12.0894 numMergedOcc 0
4 mol 96 unq 0 iso 0 dist 8.36933 6.1183 9.25941 12.5479 6.19867 13.3443 numMergedOcc 0
5 mol 96 unq 1 iso 0 dist 6.55474 7.07343 8.40684 10.7784 8.35452 11.1777 numMergedOcc 0
6 mol 96 unq 2 iso 0 dist 6.64899 5.98026 8.40684 5.82685 8.35452 11.1777 numMergedOcc 0
7 mol 96 unq 3 iso 0 dist 8.02307 7.13132 8.40684 5.3958 8.35452 11.1777 numMergedOcc 0
8 mol 96 unq 4 iso 0 dist 6.68473 8.82781 9.25941 6.48746 6.19867 13.3443 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 7.91934 4.81432 5.62903 6.7184 6.5258 4.87668 numMergedOcc 0
10 mol 125 unq 0 iso 0 dist 8.87869 10.394 9.5205 5.48201 6.39794 7.14674 numMergedOcc 0
11 mol 125 unq 1 iso 0 dist 8.87869 10.4562 7.1608 5.48201 6.39794 5.40131 numMergedOcc 0
12 mol 125 unq 2 iso 0 dist 7.69802 9.99719 9.5205 7.82785 6.39794 7.14674 numMergedOcc 0
13 mol 125 unq 3 iso 0 dist 7.69802 5.34174 7.1608 7.82785 6.39794 5.40131 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 8.59967 13.8802 6.25968 5.08964 8.75736 12.0992 numMergedOcc 0
15 mol 134 unq 1 iso 0 dist 8.59967 13.8802 6.25968 10.9353 6.32178 4.8408 numMergedOcc 0
16 mol 152 unq 0 iso 0 dist 9.44435 4.91732 9.07154 12.8882 9.37459 14.5814 numMergedOcc 0
17 mol 152 unq 1 iso 0 dist 9.44435 4.91732 9.07154 16.0649 9.0847 16.8649 numMergedOcc 0
18 mol 152 unq 2 iso 0 dist 9.44435 4.91732 9.07154 10.6678 6.00061 12.692 numMergedOcc 0
19 mol 152 unq 3 iso 0 dist 9.44435 4.91732 9.07154 12.9783 8.33302 15.1967 numMergedOcc 0
20 mol 210 unq 0 iso 0 dist 6.8631 8.60466 5.89811 13.0116 7.86668 5.4508 numMergedOcc 0
21 mol 234 unq 0 iso 0 dist 6.96979 9.03257 5.68265 6.48163 7.17032 4.93623 numMergedOcc 0
22 mol 241 unq 0 iso 0 dist 6.8951 5.44852 5.42605 6.14115 8.18588 7.3737 numMergedOcc 0
23 mol 241 unq 1 iso 0 dist 5.65753 5.88645 5.42605 12.1949 8.18588 7.3737 numMergedOcc 0
24 mol 241 unq 2 iso 0 dist 7.31224 11.3563 5.42605 14.3991 8.18588 7.3737 numMergedOcc 0
25 mol 267 unq 0 iso 0 dist 8.41273 4.75234 7.21009 5.18131 6.54381 7.22349 numMergedOcc 0
26 mol 281 unq 0 iso 0 dist 9.79394 13.3861 7.90993 6.83107 7.04661 7.85489 numMergedOcc 0
27 mol 281 unq 1 iso 0 dist 6.52115 3.90611 7.90993 5.22248 7.04661 7.85489 numMergedOcc 0
