0 mol 24 unq 0 iso 0 dist 6.86014 7.95042 5.69214 5.86882 10.0889 8.21811 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.86014 7.95042 5.69214 9.9259 9.11809 5.13078 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 8.86116 7.95042 5.11636 5.86882 6.07553 8.21811 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 8.86116 7.95042 5.11636 9.9259 6.48457 5.13078 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 7.36323 8.87744 6.28159 10.576 10.7243 4.90881 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 7.36323 8.87744 6.28159 8.94148 13.0477 9.39956 numMergedOcc 0
6 mol 24 unq 6 iso 0 dist 7.36323 7.27472 5.50396 11.7026 8.80127 8.70016 numMergedOcc 0
7 mol 24 unq 7 iso 0 dist 7.36323 7.27472 5.50396 10.576 10.7243 6.15382 numMergedOcc 0
8 mol 24 unq 8 iso 0 dist 7.36323 7.27472 5.50396 6.39013 10.6494 6.63216 numMergedOcc 0
9 mol 25 unq 0 iso 0 dist 7.57578 4.79873 10.2864 7.19007 12.9796 7.21175 numMergedOcc 0
10 mol 25 unq 1 iso 0 dist 7.17969 4.79873 11.4148 7.19007 12.3239 7.21175 numMergedOcc 0
11 mol 73 unq 0 iso 0 dist 9.38498 9.73086 17.4121 8.00278 16.2514 8.95637 numMergedOcc 0
12 mol 73 unq 1 iso 0 dist 9.96396 9.73086 5.70116 8.00278 13.1245 8.95637 numMergedOcc 0
13 mol 73 unq 2 iso 0 dist 6.19304 7.4369 5.70116 10.4159 13.1245 8.95637 numMergedOcc 0
14 mol 73 unq 3 iso 0 dist 9.75218 9.73086 14.844 8.00278 16.0336 8.95637 numMergedOcc 0
15 mol 92 unq 0 iso 0 dist 9.33898 7.06939 4.3481 11.3241 12.5352 8.806 numMergedOcc 0
16 mol 95 unq 0 iso 0 dist 7.27724 9.3948 3.94537 14.2706 8.69749 9.44847 numMergedOcc 0
17 mol 95 unq 1 iso 0 dist 7.27724 9.3948 3.94537 11.0946 5.96576 6.05839 numMergedOcc 0
18 mol 95 unq 2 iso 0 dist 9.03572 8.27883 4.99174 9.82384 12.3553 7.64172 numMergedOcc 0
19 mol 95 unq 3 iso 0 dist 8.83255 8.27883 8.67311 9.82384 14.5025 7.64172 numMergedOcc 0
20 mol 95 unq 4 iso 0 dist 8.03644 9.3948 11.3215 14.2706 16.0612 9.44847 numMergedOcc 0
21 mol 95 unq 5 iso 0 dist 8.03644 9.3948 11.3215 11.0946 14.145 6.05839 numMergedOcc 0
22 mol 95 unq 6 iso 0 dist 8.03644 8.27883 15.6249 9.82384 14.6852 7.64172 numMergedOcc 0
23 mol 119 unq 0 iso 0 dist 8.73993 7.64052 9.68677 6.42493 11.8946 4.22806 numMergedOcc 0
24 mol 119 unq 1 iso 0 dist 9.87172 6.99446 6.20019 4.55137 8.20715 4.22806 numMergedOcc 0
25 mol 119 unq 2 iso 0 dist 6.18601 8.95212 4.39676 7.36889 6.16081 4.22806 numMergedOcc 0
26 mol 133 unq 0 iso 0 dist 6.29155 8.77023 13.0405 5.58281 10.6168 5.47256 numMergedOcc 0
27 mol 133 unq 1 iso 0 dist 6.80239 8.77023 13.7612 5.58281 8.75049 5.47256 numMergedOcc 0
28 mol 133 unq 2 iso 0 dist 8.00618 8.77023 15.0115 5.58281 10.6275 5.47256 numMergedOcc 0
29 mol 134 unq 0 iso 0 dist 8.94367 9.33094 7.41373 11.0384 13.0397 6.71328 numMergedOcc 0
30 mol 134 unq 1 iso 0 dist 6.37586 9.33094 10.8635 11.0384 14.911 6.71328 numMergedOcc 0
31 mol 134 unq 2 iso 0 dist 6.49416 9.33094 12.3479 11.0384 14.2176 6.71328 numMergedOcc 0
32 mol 134 unq 3 iso 0 dist 9.86662 9.1998 12.8086 12.3235 13.0397 5.35285 numMergedOcc 0
33 mol 134 unq 4 iso 0 dist 9.86662 8.69531 7.41373 12.3235 13.0397 6.71328 numMergedOcc 0
34 mol 134 unq 5 iso 0 dist 9.71307 9.1998 15.0225 12.3235 14.911 5.35285 numMergedOcc 0
35 mol 134 unq 6 iso 0 dist 9.71307 8.69531 10.8635 12.3235 14.911 6.71328 numMergedOcc 0
36 mol 142 unq 0 iso 0 dist 9.2313 7.81207 4.67662 6.05056 10.1107 7.80044 numMergedOcc 0
37 mol 142 unq 1 iso 0 dist 5.31024 6.14151 4.67662 6.24222 10.1107 7.80044 numMergedOcc 0
38 mol 142 unq 2 iso 0 dist 7.73169 7.81207 5.81599 6.05056 11.3512 7.80044 numMergedOcc 0
39 mol 142 unq 3 iso 0 dist 7.26382 6.14151 5.81599 6.24222 11.3512 7.80044 numMergedOcc 0
40 mol 142 unq 4 iso 0 dist 8.96657 7.81207 11.1 6.05056 14.5043 7.80044 numMergedOcc 0
41 mol 167 unq 0 iso 0 dist 9.87651 7.02548 11.6011 12.6156 20.1435 9.12343 numMergedOcc 0
42 mol 186 unq 0 iso 0 dist 7.54065 6.61112 11.0961 4.527 9.83935 7.54492 numMergedOcc 0
43 mol 192 unq 0 iso 0 dist 5.59424 5.64942 6.35474 6.22871 10.1596 8.70333 numMergedOcc 0
44 mol 192 unq 1 iso 0 dist 7.00794 6.97962 6.35474 4.35125 10.1596 8.70333 numMergedOcc 0
45 mol 227 unq 0 iso 0 dist 7.22101 5.23634 5.0317 6.16261 9.68793 8.60053 numMergedOcc 0
46 mol 227 unq 1 iso 0 dist 8.65997 6.91318 5.0317 11.3848 9.68793 8.60053 numMergedOcc 0
47 mol 227 unq 2 iso 0 dist 7.09863 5.23634 5.83175 6.16261 6.40086 8.60053 numMergedOcc 0
48 mol 239 unq 0 iso 0 dist 6.16342 6.73665 10.6736 11.1638 12.8022 9.24224 numMergedOcc 0
49 mol 252 unq 0 iso 0 dist 7.19638 7.15764 7.40852 3.6688 6.38733 9.03266 numMergedOcc 0
50 mol 277 unq 0 iso 0 dist 9.7748 6.92711 14.772 13.9518 20.2102 9.80035 numMergedOcc 0
