0 mol 0 unq 0 iso 0 dist 7.96742 5.55156 11.962 7.1599 15.0192 7.15528 11.0073 17.4354 9.46298 7.40865 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 8.24206 9.5614 13.3337 5.25456 7.37981 7.15528 7.79534 6.63977 9.46298 7.40865 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 6.19218 9.5614 6.83587 5.25456 7.19621 7.15528 7.79534 4.76647 9.46298 7.40865 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 7.19397 5.55156 6.83587 7.1599 7.19621 7.15528 11.0073 4.76647 9.46298 7.40865 numMergedOcc 0
4 mol 7 unq 0 iso 0 dist 8.41173 6.22892 6.3027 7.15287 13.8674 8.41585 12.916 18.2293 12.0193 5.99972 numMergedOcc 0
5 mol 7 unq 1 iso 0 dist 8.14952 5.83658 4.92824 10.826 13.7022 9.60499 9.89388 11.2373 6.55304 6.7985 numMergedOcc 0
6 mol 7 unq 2 iso 0 dist 8.14952 5.83658 4.92824 10.826 13.7022 9.60499 14.2616 17.0071 12.2869 6.44736 numMergedOcc 0
7 mol 16 unq 0 iso 0 dist 9.31149 9.04834 9.14256 6.05535 10.2723 4.7319 5.36911 4.74317 6.51133 6.72833 numMergedOcc 0
8 mol 16 unq 1 iso 0 dist 9.31149 8.17898 7.59626 5.72175 10.6144 5.05803 5.36911 4.74317 5.30082 6.93532 numMergedOcc 0
9 mol 19 unq 0 iso 0 dist 9.3147 7.84393 10.5285 9.01721 13.1233 7.82074 10.7145 10.1168 6.01808 6.41575 numMergedOcc 0
10 mol 19 unq 1 iso 0 dist 9.79426 7.84393 9.84922 9.01721 13.8602 7.82074 10.7145 15.5419 6.01808 6.41575 numMergedOcc 0
11 mol 60 unq 0 iso 0 dist 9.54864 8.8058 6.0993 10.0675 13.4395 8.7531 8.04272 5.86954 7.04075 9.90939 numMergedOcc 0
12 mol 64 unq 0 iso 0 dist 9.3473 9.10915 9.82646 9.73304 16.6744 9.67592 12.219 15.0857 6.21578 9.97159 numMergedOcc 0
13 mol 64 unq 1 iso 0 dist 8.14932 8.66921 9.82646 10.8918 16.6744 9.67592 14.1509 15.0857 6.21578 9.97159 numMergedOcc 0
14 mol 64 unq 2 iso 0 dist 6.17846 8.66921 5.33496 10.8918 11.6303 9.67592 14.1509 11.3115 6.21578 9.97159 numMergedOcc 0
15 mol 64 unq 3 iso 0 dist 6.08228 5.54343 5.33496 5.59762 11.6303 9.67592 9.23947 11.3115 6.21578 9.97159 numMergedOcc 0
16 mol 73 unq 0 iso 0 dist 5.39171 6.30194 5.2774 10.5627 6.89722 6.19304 10.9561 11.5412 6.56633 9.24757 numMergedOcc 0
17 mol 73 unq 1 iso 0 dist 9.27355 6.30194 5.44275 10.5627 7.26679 6.19304 10.9561 11.2253 6.56633 9.24757 numMergedOcc 0
18 mol 73 unq 2 iso 0 dist 8.60363 6.30194 8.0624 10.5627 10.1503 6.19304 10.9561 14.5478 6.56633 9.24757 numMergedOcc 0
19 mol 100 unq 0 iso 0 dist 6.60356 9.57498 14.3495 6.89762 11.5472 6.45675 12.7644 15.4053 7.11701 7.38135 numMergedOcc 0
20 mol 114 unq 0 iso 0 dist 5.31281 9.24515 7.18757 5.24877 8.42445 7.5732 11.4347 12.5697 7.436 6.84011 numMergedOcc 0
21 mol 114 unq 1 iso 0 dist 8.9922 9.24515 7.13921 5.24877 10.2889 7.5732 11.4347 13.6759 7.436 6.84011 numMergedOcc 0
22 mol 115 unq 0 iso 0 dist 7.67341 8.35604 5.39296 5.3967 6.7225 5.11551 11.0607 6.39438 6.77806 6.92026 numMergedOcc 0
23 mol 115 unq 1 iso 0 dist 7.67341 8.35604 5.39296 11.9798 10.2695 7.11972 11.0607 6.39438 6.77806 5.88249 numMergedOcc 0
24 mol 119 unq 0 iso 0 dist 8.24549 6.85677 5.19198 4.99061 6.49205 6.18601 11.6949 6.25204 10.4376 8.00003 numMergedOcc 0
25 mol 143 unq 0 iso 0 dist 6.68364 5.30872 5.4432 6.3915 9.32441 5.99315 9.99577 6.48478 6.48978 7.78652 numMergedOcc 0
26 mol 143 unq 1 iso 0 dist 6.68364 5.30872 5.4432 6.3915 9.32441 5.99315 10.2769 7.09076 5.20762 8.91301 numMergedOcc 0
27 mol 181 unq 0 iso 0 dist 6.47689 9.63295 5.16386 12.5935 11.5992 7.63312 17.0911 16.2544 12.5387 5.94469 numMergedOcc 0
28 mol 210 unq 0 iso 0 dist 6.24111 8.07523 5.82028 13.3929 9.67457 6.18308 12.8837 11.6718 5.87279 7.10826 numMergedOcc 0
29 mol 210 unq 1 iso 0 dist 9.00343 7.56882 5.82028 12.3088 9.67457 6.18308 10.5315 11.6718 5.87279 7.10826 numMergedOcc 0
30 mol 210 unq 2 iso 0 dist 8.60412 8.07523 4.62641 13.3929 9.90494 6.18308 12.8837 5.36996 5.87279 7.10826 numMergedOcc 0
31 mol 210 unq 3 iso 0 dist 7.05535 7.56882 4.62641 12.3088 9.90494 6.18308 10.5315 5.36996 5.87279 7.10826 numMergedOcc 0
32 mol 220 unq 0 iso 0 dist 7.86207 8.9077 4.90657 10.6943 9.8711 9.23153 7.46122 4.39102 7.11498 6.59716 numMergedOcc 0
33 mol 231 unq 0 iso 0 dist 7.28719 9.98232 5.3251 10.9863 7.79865 7.37839 13.7652 7.00432 6.37275 6.98875 numMergedOcc 0
34 mol 231 unq 1 iso 0 dist 7.28719 9.98232 5.3251 10.2117 6.14348 8.40182 13.7652 7.00432 6.37275 6.54852 numMergedOcc 0
35 mol 232 unq 0 iso 0 dist 5.92175 7.47238 4.90814 10.134 11.2186 8.27212 9.78197 5.39184 4.9377 9.40808 numMergedOcc 0
36 mol 238 unq 0 iso 0 dist 6.74214 7.98022 6.62361 6.3873 9.31417 5.72887 12.3944 16.7165 14.7883 9.24557 numMergedOcc 0
37 mol 238 unq 1 iso 0 dist 5.33462 7.98022 5.96552 6.3873 5.56719 5.72887 12.3944 11.9863 14.7883 9.24557 numMergedOcc 0
38 mol 239 unq 0 iso 0 dist 8.34832 9.27989 11.4465 12.1502 15.8376 6.16342 12.9792 13.0831 4.30299 8.84636 numMergedOcc 0
39 mol 241 unq 0 iso 0 dist 9.174 6.40592 4.86437 7.93809 9.72526 7.4631 10.2312 7.18308 4.45049 7.89524 numMergedOcc 0
40 mol 261 unq 0 iso 0 dist 6.41477 7.15785 4.50761 6.5875 10.2386 8.02547 11.3138 10.4088 5.91643 8.43974 numMergedOcc 0
41 mol 261 unq 1 iso 0 dist 6.41477 9.43169 8.80293 6.5875 10.2386 6.05727 11.3138 10.4088 5.02383 8.43974 numMergedOcc 0
42 mol 282 unq 0 iso 0 dist 7.93511 6.84554 4.58403 9.67023 5.67266 8.76532 14.0832 7.46507 8.12478 9.0975 numMergedOcc 0
43 mol 282 unq 1 iso 0 dist 7.93511 9.51581 5.04235 9.67023 5.67266 6.33524 14.0832 7.46507 5.0324 9.0975 numMergedOcc 0
44 mol 282 unq 2 iso 0 dist 5.62497 8.58671 4.85461 8.13794 9.63346 8.04483 13.3375 10.4926 5.65568 9.0975 numMergedOcc 0
