0 mol 7 unq 0 iso 0 dist 6.36911 6.28925 7.58143 9.68596 13.0969 5.82034 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 8.33604 5.89134 5.93269 8.53529 11.4716 6.38783 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 9.87449 8.07369 12.31 8.64915 10.9409 9.84125 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 9.87449 8.07369 12.31 8.17347 8.50857 6.12805 numMergedOcc 0
4 mol 9 unq 2 iso 0 dist 9.87449 8.07369 12.31 7.83133 6.89307 6.78475 numMergedOcc 0
5 mol 19 unq 0 iso 0 dist 8.78293 7.97324 6.37382 7.75618 6.2337 10.3824 numMergedOcc 0
6 mol 19 unq 1 iso 0 dist 8.23643 7.97324 7.24362 7.75618 14.4867 10.3824 numMergedOcc 0
7 mol 19 unq 2 iso 0 dist 7.82528 7.97324 13.3417 7.75618 11.4087 10.3824 numMergedOcc 0
8 mol 21 unq 0 iso 0 dist 6.08338 9.35137 8.37543 9.06424 10.2036 4.8139 numMergedOcc 0
9 mol 21 unq 1 iso 0 dist 6.08338 7.81429 7.51251 9.06424 10.2036 12.1147 numMergedOcc 0
10 mol 21 unq 2 iso 0 dist 6.08338 9.39415 5.4965 9.06424 10.2036 13.6338 numMergedOcc 0
11 mol 24 unq 0 iso 0 dist 9.75144 9.61998 5.09339 7.33768 5.90981 4.86245 numMergedOcc 0
12 mol 24 unq 1 iso 0 dist 9.75144 9.61998 5.09339 9.01567 13.2265 12.4877 numMergedOcc 0
13 mol 24 unq 2 iso 0 dist 9.75144 9.61998 5.09339 7.29868 13.719 14.5906 numMergedOcc 0
14 mol 43 unq 0 iso 0 dist 9.83618 6.79185 6.17433 8.95682 4.54282 7.95596 numMergedOcc 0
15 mol 52 unq 0 iso 0 dist 7.18176 5.75761 8.12937 6.31696 6.29814 10.9229 numMergedOcc 0
16 mol 72 unq 0 iso 0 dist 6.77912 8.96978 6.33215 9.27838 4.67641 10.2373 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 7.98142 8.47008 5.3049 5.94469 8.93991 11.0205 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 7.37327 8.47008 10.8044 5.94469 5.35588 11.0205 numMergedOcc 0
19 mol 197 unq 0 iso 0 dist 8.99696 8.02386 5.93544 7.50013 11.1666 6.08776 numMergedOcc 0
20 mol 197 unq 1 iso 0 dist 8.99696 8.02386 5.93544 5.81233 13.3562 9.67405 numMergedOcc 0
21 mol 197 unq 2 iso 0 dist 8.99696 8.02386 5.93544 6.92924 4.59269 6.34927 numMergedOcc 0
22 mol 197 unq 3 iso 0 dist 8.99696 8.02386 5.93544 7.14306 12.9766 12.7634 numMergedOcc 0
23 mol 197 unq 4 iso 0 dist 8.99696 6.6259 9.85132 7.50013 11.1666 11.529 numMergedOcc 0
24 mol 197 unq 5 iso 0 dist 8.99696 6.6259 9.85132 5.81233 13.3562 11.1317 numMergedOcc 0
25 mol 197 unq 6 iso 0 dist 8.99696 6.6259 9.85132 6.92924 4.59269 6.01177 numMergedOcc 0
26 mol 197 unq 7 iso 0 dist 8.99696 6.6259 9.85132 7.14306 12.9766 4.09986 numMergedOcc 0
27 mol 197 unq 8 iso 0 dist 7.85058 8.02386 10.8955 7.50013 5.53129 6.08776 numMergedOcc 0
28 mol 197 unq 9 iso 0 dist 7.85058 8.02386 10.8955 5.81233 4.38296 9.67405 numMergedOcc 0
29 mol 197 unq 10 iso 0 dist 7.85058 8.02386 10.8955 6.92924 11.3267 6.34927 numMergedOcc 0
30 mol 197 unq 11 iso 0 dist 7.85058 8.02386 10.8955 7.14306 8.05362 12.7634 numMergedOcc 0
31 mol 197 unq 12 iso 0 dist 7.85058 6.6259 10.636 7.50013 5.53129 11.529 numMergedOcc 0
32 mol 197 unq 13 iso 0 dist 7.85058 6.6259 10.636 5.81233 4.38296 11.1317 numMergedOcc 0
33 mol 197 unq 14 iso 0 dist 7.85058 6.6259 10.636 6.92924 11.3267 6.01177 numMergedOcc 0
34 mol 197 unq 15 iso 0 dist 7.85058 6.6259 10.636 7.14306 8.05362 4.09986 numMergedOcc 0
35 mol 197 unq 16 iso 0 dist 9.96638 8.02386 5.28951 7.50013 6.46195 6.08776 numMergedOcc 0
36 mol 197 unq 17 iso 0 dist 9.96638 8.02386 5.28951 5.81233 11.0356 9.67405 numMergedOcc 0
37 mol 197 unq 18 iso 0 dist 9.96638 8.02386 5.28951 6.92924 6.31157 6.34927 numMergedOcc 0
38 mol 197 unq 19 iso 0 dist 9.96638 8.02386 5.28951 7.14306 11.5276 12.7634 numMergedOcc 0
39 mol 197 unq 20 iso 0 dist 9.96638 6.6259 10.698 7.50013 6.46195 11.529 numMergedOcc 0
40 mol 197 unq 21 iso 0 dist 9.96638 6.6259 10.698 5.81233 11.0356 11.1317 numMergedOcc 0
41 mol 197 unq 22 iso 0 dist 9.96638 6.6259 10.698 6.92924 6.31157 6.01177 numMergedOcc 0
42 mol 197 unq 23 iso 0 dist 9.96638 6.6259 10.698 7.14306 11.5276 4.09986 numMergedOcc 0
43 mol 205 unq 0 iso 0 dist 9.19704 6.52987 11.6274 6.03688 14.6029 7.69374 numMergedOcc 0
44 mol 213 unq 0 iso 0 dist 6.0965 8.29133 10.4683 7.37798 6.17282 14.6555 numMergedOcc 0
45 mol 213 unq 1 iso 0 dist 6.0965 8.29133 10.4683 7.73322 10.5013 4.14961 numMergedOcc 0
46 mol 213 unq 2 iso 0 dist 9.59129 8.29133 8.3461 7.37798 12.1116 14.6555 numMergedOcc 0
47 mol 213 unq 3 iso 0 dist 9.59129 8.29133 8.3461 7.73322 9.93085 4.14961 numMergedOcc 0
48 mol 219 unq 0 iso 0 dist 4.87541 5.40597 7.57664 7.59632 3.92926 9.99563 numMergedOcc 0
49 mol 234 unq 0 iso 0 dist 6.25105 7.72403 6.81789 9.81425 13.0631 10.8078 numMergedOcc 0
50 mol 234 unq 1 iso 0 dist 6.16063 7.27632 10.6582 6.30154 5.70413 12.1933 numMergedOcc 0
51 mol 234 unq 2 iso 0 dist 6.16063 7.27632 10.6582 7.32499 7.17691 5.20198 numMergedOcc 0
52 mol 235 unq 0 iso 0 dist 6.98084 7.48753 6.12136 8.69356 11.921 7.26986 numMergedOcc 0
53 mol 240 unq 0 iso 0 dist 6.15305 7.55134 7.23992 6.68687 9.66581 10.9665 numMergedOcc 0
54 mol 240 unq 1 iso 0 dist 8.0951 7.55134 7.3073 6.68687 7.03039 10.9665 numMergedOcc 0
55 mol 284 unq 0 iso 0 dist 4.86729 8.06073 6.36552 6.78191 6.76453 8.34088 numMergedOcc 0
