0 mol 7 unq 0 iso 0 dist 9.04663 8.44333 13.5227 6.70503 8.80762 7.78327 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 6.73143 8.3038 3.98123 4.61575 9.78051 12.2161 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 6.48339 4.74574 4.74563 5.44752 8.64015 9.45821 numMergedOcc 0
3 mol 119 unq 0 iso 0 dist 8.38498 6.3646 9.53672 6.77381 6.98934 7.60162 numMergedOcc 0
4 mol 154 unq 0 iso 0 dist 6.89591 5.55632 4.83835 10.8466 7.72144 10.5628 numMergedOcc 0
5 mol 162 unq 0 iso 0 dist 8.47144 9.93616 12.7949 6.66205 8.00506 15.754 numMergedOcc 0
6 mol 171 unq 0 iso 0 dist 5.94881 8.00826 11.6193 7.24557 9.11712 11.9039 numMergedOcc 0
7 mol 194 unq 0 iso 0 dist 8.26119 9.3032 7.82899 5.69334 6.26839 9.52922 numMergedOcc 0
8 mol 194 unq 1 iso 0 dist 8.26119 9.3032 7.82899 13.2099 8.12346 11.2599 numMergedOcc 0
9 mol 194 unq 2 iso 0 dist 8.26119 9.3032 7.82899 16.2258 8.83356 14.7152 numMergedOcc 0
10 mol 194 unq 3 iso 0 dist 8.26119 9.3032 7.82899 13.4175 8.2654 14.7929 numMergedOcc 0
11 mol 194 unq 4 iso 0 dist 9.10338 8.10451 7.82899 13.5654 6.26839 9.52922 numMergedOcc 0
12 mol 194 unq 5 iso 0 dist 9.10338 8.10451 7.82899 10.2888 8.12346 11.2599 numMergedOcc 0
13 mol 194 unq 6 iso 0 dist 9.10338 8.10451 7.82899 11.1617 8.83356 14.7152 numMergedOcc 0
14 mol 194 unq 7 iso 0 dist 9.10338 8.10451 7.82899 13.9257 8.2654 14.7929 numMergedOcc 0
15 mol 194 unq 8 iso 0 dist 9.10338 6.6747 10.0237 13.5654 6.26839 11.7672 numMergedOcc 0
16 mol 194 unq 9 iso 0 dist 9.10338 6.6747 10.0237 10.2888 8.12346 11.0369 numMergedOcc 0
17 mol 194 unq 10 iso 0 dist 9.10338 6.6747 10.0237 11.1617 8.83356 15.9798 numMergedOcc 0
18 mol 194 unq 11 iso 0 dist 9.10338 6.6747 10.0237 13.9257 8.2654 15.7836 numMergedOcc 0
19 mol 248 unq 0 iso 0 dist 9.68147 7.9475 11.6449 9.56932 6.77954 13.9966 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 6.51617 8.86773 10.1436 6.30874 8.15467 11.3432 numMergedOcc 0
21 mol 258 unq 1 iso 0 dist 6.51617 8.86773 10.1436 6.88723 9.1925 14.4469 numMergedOcc 0
22 mol 258 unq 2 iso 0 dist 6.51617 8.95095 10.6472 6.30874 8.15467 5.4557 numMergedOcc 0
23 mol 258 unq 3 iso 0 dist 6.51617 8.95095 10.6472 6.88723 9.1925 9.62202 numMergedOcc 0
24 mol 264 unq 0 iso 0 dist 8.43465 8.26228 8.89888 9.51384 7.52281 14.7806 numMergedOcc 0
25 mol 264 unq 1 iso 0 dist 8.43465 8.26228 8.89888 10.2047 6.42588 10.4401 numMergedOcc 0
26 mol 285 unq 0 iso 0 dist 6.98595 8.88717 4.12133 5.23192 5.31728 6.71946 numMergedOcc 0
27 mol 285 unq 1 iso 0 dist 8.32103 9.84651 4.12133 9.00041 5.31728 6.71946 numMergedOcc 0
28 mol 294 unq 0 iso 0 dist 9.66445 9.32126 14.0151 16.3624 9.13907 22.8109 numMergedOcc 0
29 mol 294 unq 1 iso 0 dist 9.66445 9.38111 17.6199 16.3624 9.13907 25.1168 numMergedOcc 0
30 mol 294 unq 2 iso 0 dist 9.66445 9.14005 11.9969 16.3624 9.13907 20.9705 numMergedOcc 0
