0 mol 72 unq 0 iso 0 dist 4.69674 4.86198 3.93249 4.7874 6.48394 6.79423 numMergedOcc 0
1 mol 78 unq 0 iso 0 dist 8.72013 7.91148 11.1097 12.3916 9.15754 13.4981 numMergedOcc 0
2 mol 78 unq 1 iso 0 dist 8.72013 6.59794 12.3433 12.3916 9.15754 15.0206 numMergedOcc 0
3 mol 78 unq 2 iso 0 dist 8.72013 8.34957 7.34534 12.3916 9.15754 10.7823 numMergedOcc 0
4 mol 81 unq 0 iso 0 dist 6.4687 9.62234 6.05544 5.62545 7.15043 10.2688 numMergedOcc 0
5 mol 81 unq 1 iso 0 dist 6.4687 9.62234 6.05544 8.0518 5.70283 10.9128 numMergedOcc 0
6 mol 81 unq 2 iso 0 dist 6.67147 9.62234 4.45069 5.62545 5.86142 10.2688 numMergedOcc 0
7 mol 81 unq 3 iso 0 dist 6.67147 9.62234 4.45069 8.0518 7.16741 10.9128 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 8.81824 8.04242 7.59896 16.2205 9.43843 17.0286 numMergedOcc 0
9 mol 85 unq 1 iso 0 dist 8.81824 8.04242 7.59896 8.37717 7.67463 4.18248 numMergedOcc 0
10 mol 95 unq 0 iso 0 dist 8.82395 6.38004 5.08555 11.8395 9.36638 10.9714 numMergedOcc 0
11 mol 116 unq 0 iso 0 dist 8.10448 8.51123 4.89202 5.49724 7.39112 6.55227 numMergedOcc 0
12 mol 120 unq 0 iso 0 dist 8.1671 7.53694 3.47821 3.824 9.43682 7.84207 numMergedOcc 0
13 mol 120 unq 1 iso 0 dist 8.1671 7.53694 3.47821 4.96885 8.0564 8.56947 numMergedOcc 0
14 mol 120 unq 2 iso 0 dist 8.1671 8.38358 6.10769 3.824 9.43682 6.98791 numMergedOcc 0
15 mol 120 unq 3 iso 0 dist 8.1671 8.38358 6.10769 4.96885 8.0564 11.3644 numMergedOcc 0
16 mol 206 unq 0 iso 0 dist 9.73419 4.51255 9.90756 4.46135 9.24832 6.80296 numMergedOcc 0
17 mol 206 unq 1 iso 0 dist 6.11803 6.23183 9.90756 3.56132 9.24832 6.80296 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 7.98028 6.76495 4.05528 5.6683 8.27566 9.53717 numMergedOcc 0
19 mol 258 unq 1 iso 0 dist 5.8473 7.12221 8.70164 5.82277 8.27566 12.3103 numMergedOcc 0
20 mol 258 unq 2 iso 0 dist 5.8473 5.4557 4.05528 5.82277 8.27566 9.53717 numMergedOcc 0
21 mol 278 unq 0 iso 0 dist 5.77089 5.35705 5.04677 5.33325 9.68335 9.32042 numMergedOcc 0
