0 mol 7 unq 0 iso 0 dist 9.02869 15.4291 9.28571 13.9246 9.49373 5.19202 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.02869 14.326 8.05125 13.9246 9.49373 16.7503 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.84944 11.3412 7.67459 4.64937 5.51659 6.82158 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 7.21995 5.88097 7.67459 7.95541 5.51659 6.82158 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 5.35252 10.6637 9.79657 6.39496 8.80801 12.5527 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 8.7142 8.23824 5.37449 6.50601 8.79971 4.55325 numMergedOcc 0
6 mol 87 unq 0 iso 0 dist 6.22441 4.54351 7.35921 4.40643 9.42123 4.78036 numMergedOcc 0
7 mol 87 unq 1 iso 0 dist 6.22441 4.54351 7.35921 13.0389 9.67406 11.8835 numMergedOcc 0
8 mol 87 unq 2 iso 0 dist 5.91543 6.17843 9.78949 4.40643 9.18848 9.29573 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 9.88178 15.6097 8.15734 10.6134 7.76297 6.82156 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 9.88178 5.57607 6.00896 10.6134 7.76297 5.60785 numMergedOcc 0
11 mol 140 unq 0 iso 0 dist 9.13339 5.90456 6.55217 5.01433 9.8553 4.63095 numMergedOcc 0
12 mol 140 unq 1 iso 0 dist 7.60956 5.00766 6.55217 5.30674 9.8553 4.63095 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 9.65031 12.1354 9.27341 5.05633 6.89622 7.18925 numMergedOcc 0
14 mol 152 unq 1 iso 0 dist 8.51844 6.67687 9.27341 6.97725 6.89622 7.18925 numMergedOcc 0
15 mol 183 unq 0 iso 0 dist 8.97652 4.92164 9.84649 6.26917 9.01322 10.7823 numMergedOcc 0
16 mol 183 unq 1 iso 0 dist 8.97652 4.92164 9.84649 9.55477 5.89091 10.2182 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 4.81837 6.25023 7.25362 6.89035 5.8325 5.18043 numMergedOcc 0
18 mol 209 unq 0 iso 0 dist 9.79293 8.95238 6.82209 9.75303 8.21628 5.18002 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 5.25149 8.17619 9.57625 6.555 7.81237 11.6555 numMergedOcc 0
20 mol 220 unq 1 iso 0 dist 8.6368 7.36665 9.984 14.0074 9.33769 11.799 numMergedOcc 0
21 mol 220 unq 2 iso 0 dist 8.6368 7.36665 9.984 12.2375 6.25503 12.9743 numMergedOcc 0
22 mol 220 unq 3 iso 0 dist 8.6368 8.17619 8.08702 14.0074 9.33769 8.17058 numMergedOcc 0
23 mol 220 unq 4 iso 0 dist 8.6368 8.17619 8.08702 12.2375 6.25503 6.39826 numMergedOcc 0
24 mol 239 unq 0 iso 0 dist 9.01071 13.3781 7.449 6.54029 8.45305 11.8868 numMergedOcc 0
25 mol 239 unq 1 iso 0 dist 9.01071 14.2324 8.98789 6.54029 8.45305 14.9427 numMergedOcc 0
26 mol 239 unq 2 iso 0 dist 8.86185 10.1043 7.80073 13.9599 8.39251 6.88711 numMergedOcc 0
27 mol 239 unq 3 iso 0 dist 8.86185 10.1043 7.80073 6.54029 8.99865 14.2541 numMergedOcc 0
28 mol 244 unq 0 iso 0 dist 7.79787 8.64762 6.2667 6.33602 8.92083 13.018 numMergedOcc 0
29 mol 250 unq 0 iso 0 dist 8.51703 11.6337 8.59384 11.7643 8.98805 5.0051 numMergedOcc 0
30 mol 250 unq 1 iso 0 dist 5.07895 5.95822 8.59384 5.64152 8.98805 5.0051 numMergedOcc 0
31 mol 254 unq 0 iso 0 dist 9.54511 9.66767 5.73448 8.16645 8.77315 7.62172 numMergedOcc 0
32 mol 255 unq 0 iso 0 dist 7.57779 12.1115 7.16286 13.4258 9.35269 5.27777 numMergedOcc 0
33 mol 282 unq 0 iso 0 dist 6.04225 6.0405 6.51248 6.87677 8.79823 10.3562 numMergedOcc 0
34 mol 282 unq 1 iso 0 dist 5.00258 6.38947 6.51248 4.44911 8.79823 10.3562 numMergedOcc 0
35 mol 282 unq 2 iso 0 dist 8.22117 5.98603 6.51248 9.11051 8.79823 10.3562 numMergedOcc 0
36 mol 287 unq 0 iso 0 dist 6.96774 7.43524 9.84741 4.38561 8.05825 3.27443 numMergedOcc 0
37 mol 288 unq 0 iso 0 dist 6.96774 7.43524 9.84741 4.38561 8.05825 3.27443 numMergedOcc 0
38 mol 289 unq 0 iso 0 dist 6.96774 7.43524 9.84741 4.38561 8.05825 3.27443 numMergedOcc 0
