0 mol 7 unq 0 iso 0 dist 5.77374 9.30196 6.0323 9.8603 5.70161 7.15434 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.84857 8.57713 9.58865 13.7405 8.54694 7.32392 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 7.2159 6.57228 9.77521 5.5814 5.39896 7.47342 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 5.58346 12.2435 7.84699 9.43662 8.04817 6.10011 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 5.58346 12.2435 7.84699 6.18305 5.2774 8.124 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 9.10386 12.2435 8.40844 9.43662 9.76331 6.10011 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 9.10386 12.2435 8.40844 6.18305 5.44275 8.124 numMergedOcc 0
7 mol 73 unq 4 iso 0 dist 9.10386 14.2654 7.02351 13.2599 11.2674 8.16299 numMergedOcc 0
8 mol 73 unq 5 iso 0 dist 9.66744 16.9811 7.84699 17.4326 8.04817 6.10011 numMergedOcc 0
9 mol 73 unq 6 iso 0 dist 9.66744 16.9811 7.84699 12.9661 5.2774 8.124 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 9.93688 13.3114 4.85152 14.0535 6.82886 5.90776 numMergedOcc 0
11 mol 92 unq 1 iso 0 dist 9.88184 13.3931 4.85152 10.9783 6.82886 5.90776 numMergedOcc 0
12 mol 101 unq 0 iso 0 dist 5.5199 5.2394 5.51185 9.90517 4.79998 9.3485 numMergedOcc 0
13 mol 102 unq 0 iso 0 dist 8.07962 7.92108 9.61113 14.6116 13.5433 7.42187 numMergedOcc 0
14 mol 102 unq 1 iso 0 dist 8.07962 4.9259 7.73836 11.1118 6.42572 9.84673 numMergedOcc 0
15 mol 102 unq 2 iso 0 dist 9.54857 7.92108 7.59973 14.6116 8.51668 7.42187 numMergedOcc 0
16 mol 102 unq 3 iso 0 dist 7.58908 4.51114 9.61113 11.5478 13.5433 7.42187 numMergedOcc 0
17 mol 102 unq 4 iso 0 dist 7.58908 9.29865 7.73836 12.0912 6.42572 9.84673 numMergedOcc 0
18 mol 102 unq 5 iso 0 dist 9.32058 4.51114 7.59973 11.5478 8.51668 7.42187 numMergedOcc 0
19 mol 117 unq 0 iso 0 dist 6.81489 5.76817 5.24519 12.479 6.29427 8.81172 numMergedOcc 0
20 mol 117 unq 1 iso 0 dist 9.33403 8.6257 8.30003 11.3462 10.4589 7.0318 numMergedOcc 0
21 mol 119 unq 0 iso 0 dist 8.39253 7.49885 7.26463 11.7745 9.35307 8.88255 numMergedOcc 0
22 mol 124 unq 0 iso 0 dist 7.83509 8.00585 5.61764 12.4558 5.31501 6.35314 numMergedOcc 0
23 mol 131 unq 0 iso 0 dist 8.89412 10.3282 7.8034 15.0465 8.25445 9.33945 numMergedOcc 0
24 mol 134 unq 0 iso 0 dist 9.49104 12.0027 9.21999 13.0519 10.3334 6.54987 numMergedOcc 0
25 mol 141 unq 0 iso 0 dist 6.95914 3.80626 8.51265 10.0768 13.1327 7.34465 numMergedOcc 0
26 mol 141 unq 1 iso 0 dist 6.95914 3.80626 8.51265 10.6673 10.4653 9.47675 numMergedOcc 0
27 mol 147 unq 0 iso 0 dist 5.82034 6.97601 4.95086 10.7523 5.90364 6.87299 numMergedOcc 0
28 mol 147 unq 1 iso 0 dist 6.56854 5.23184 4.95086 11.2617 5.90364 6.87299 numMergedOcc 0
29 mol 181 unq 0 iso 0 dist 6.13872 7.56512 8.03259 9.86845 6.94401 8.90247 numMergedOcc 0
30 mol 181 unq 1 iso 0 dist 6.13872 7.56512 8.03259 9.58911 5.07895 6.58792 numMergedOcc 0
31 mol 199 unq 0 iso 0 dist 7.16849 4.98653 7.29716 8.30443 4.26752 9.30897 numMergedOcc 0
32 mol 212 unq 0 iso 0 dist 7.73701 4.95466 6.41916 8.062 9.7586 9.47932 numMergedOcc 0
33 mol 218 unq 0 iso 0 dist 6.2441 6.7488 5.98076 6.9398 8.31343 4.851 numMergedOcc 0
34 mol 219 unq 0 iso 0 dist 9.52151 6.28221 7.98941 4.87446 10.9246 6.8424 numMergedOcc 0
35 mol 230 unq 0 iso 0 dist 6.61442 6.22182 5.00735 11.5522 7.07028 5.62804 numMergedOcc 0
36 mol 230 unq 1 iso 0 dist 6.61442 6.22182 5.00735 15.2718 11.491 9.3619 numMergedOcc 0
37 mol 230 unq 2 iso 0 dist 7.10283 5.18766 5.00735 9.97386 7.07028 5.62804 numMergedOcc 0
38 mol 230 unq 3 iso 0 dist 7.10283 5.18766 5.00735 14.3186 11.491 9.3619 numMergedOcc 0
39 mol 252 unq 0 iso 0 dist 8.63848 9.75362 7.74647 6.1197 4.98533 6.41821 numMergedOcc 0
40 mol 256 unq 0 iso 0 dist 9.37687 4.19031 8.11884 7.67598 9.07441 5.98967 numMergedOcc 0
41 mol 266 unq 0 iso 0 dist 9.33447 9.20929 6.35457 14.3918 5.73592 9.07043 numMergedOcc 0
42 mol 266 unq 1 iso 0 dist 3.90274 4.55986 6.35457 8.12852 5.73592 9.07043 numMergedOcc 0
43 mol 274 unq 0 iso 0 dist 8.15217 6.30262 8.26695 11.9266 12.0757 5.82876 numMergedOcc 0
44 mol 274 unq 1 iso 0 dist 8.15217 6.30262 8.26695 14.3217 16.0765 8.71129 numMergedOcc 0
45 mol 274 unq 2 iso 0 dist 7.62562 6.30262 5.59151 11.9266 7.96313 5.82876 numMergedOcc 0
46 mol 274 unq 3 iso 0 dist 7.62562 6.30262 5.59151 14.3217 13.1879 8.71129 numMergedOcc 0
