0 mol 9 unq 0 iso 0 dist 8.57077 8.47421 5.60154 8.27962 6.85412 9.29529 9.5997 9.62394 9.57198 4.45625 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.57077 8.47421 5.60154 11.4878 6.33889 7.2199 9.5997 9.62394 9.57198 6.0397 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 7.20519 7.82528 10.4988 5.5841 9.80108 10.7418 15.119 19.7849 9.85134 15.6344 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 7.20519 7.82528 10.4988 5.5841 9.80108 10.7418 4.97119 10.741 5.82366 5.90856 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 7.20519 9.80108 5.5841 5.31524 8.78293 9.95011 9.32205 10.3056 8.19695 5.60953 numMergedOcc 0
5 mol 19 unq 3 iso 0 dist 7.20519 9.80108 5.5841 5.31524 8.78293 9.95011 4.96411 7.75618 7.02548 6.2337 numMergedOcc 0
6 mol 19 unq 4 iso 0 dist 7.20519 9.80108 5.5841 11.0832 8.23643 13.6944 9.32205 10.3056 8.19695 16.5434 numMergedOcc 0
7 mol 19 unq 5 iso 0 dist 7.20519 9.80108 5.5841 11.0832 8.23643 13.6944 4.96411 7.75618 7.02548 14.4867 numMergedOcc 0
8 mol 19 unq 6 iso 0 dist 7.20519 9.80108 5.5841 10.4988 7.82528 10.7418 9.32205 10.3056 8.19695 16.6722 numMergedOcc 0
9 mol 19 unq 7 iso 0 dist 7.20519 9.80108 5.5841 10.4988 7.82528 10.7418 4.96411 7.75618 7.02548 11.4087 numMergedOcc 0
10 mol 19 unq 8 iso 0 dist 4.51865 6.20943 4.69858 6.74265 8.58657 10.7418 10.943 13.212 9.85134 15.6344 numMergedOcc 0
11 mol 19 unq 9 iso 0 dist 4.51865 6.20943 4.69858 6.74265 8.58657 10.7418 4.64838 6.41423 5.82366 5.90856 numMergedOcc 0
12 mol 19 unq 10 iso 0 dist 4.51865 8.58657 6.74265 4.69858 6.20943 10.7418 13.0631 13.287 8.19695 16.6722 numMergedOcc 0
13 mol 19 unq 11 iso 0 dist 4.51865 8.58657 6.74265 4.69858 6.20943 10.7418 7.08342 8.40416 7.02548 11.4087 numMergedOcc 0
14 mol 19 unq 12 iso 0 dist 6.864 7.82528 4.69858 5.5841 8.58657 10.7418 15.119 13.212 9.85134 15.6344 numMergedOcc 0
15 mol 19 unq 13 iso 0 dist 6.864 7.82528 4.69858 5.5841 8.58657 10.7418 4.97119 6.41423 5.82366 5.90856 numMergedOcc 0
16 mol 19 unq 14 iso 0 dist 6.864 8.58657 5.5841 11.4401 8.78293 9.95011 13.0631 10.3056 8.19695 5.60953 numMergedOcc 0
17 mol 19 unq 15 iso 0 dist 6.864 8.58657 5.5841 11.4401 8.78293 9.95011 7.08342 7.75618 7.02548 6.2337 numMergedOcc 0
18 mol 19 unq 16 iso 0 dist 6.864 8.58657 5.5841 12.3093 8.23643 13.6944 13.0631 10.3056 8.19695 16.5434 numMergedOcc 0
19 mol 19 unq 17 iso 0 dist 6.864 8.58657 5.5841 12.3093 8.23643 13.6944 7.08342 7.75618 7.02548 14.4867 numMergedOcc 0
20 mol 19 unq 18 iso 0 dist 6.864 8.58657 5.5841 4.69858 7.82528 10.7418 13.0631 10.3056 8.19695 16.6722 numMergedOcc 0
21 mol 19 unq 19 iso 0 dist 6.864 8.58657 5.5841 4.69858 7.82528 10.7418 7.08342 7.75618 7.02548 11.4087 numMergedOcc 0
22 mol 45 unq 0 iso 0 dist 7.58835 9.20119 6.89191 5.67689 6.34173 8.59109 10.7082 10.6216 5.55096 8.70414 numMergedOcc 0
23 mol 58 unq 0 iso 0 dist 7.32874 6.40841 6.75888 4.55117 8.26899 8.80108 7.12541 7.21955 8.71468 10.8421 numMergedOcc 0
24 mol 58 unq 1 iso 0 dist 6.86465 8.63333 6.47744 5.92889 9.58673 7.01363 10.2049 8.80614 9.11258 8.88332 numMergedOcc 0
25 mol 58 unq 2 iso 0 dist 6.35756 8.89374 6.47744 7.05413 9.58673 7.01363 5.49591 8.80614 9.11258 8.88332 numMergedOcc 0
26 mol 58 unq 3 iso 0 dist 9.55426 9.73139 13.1021 10.3782 8.26899 12.8396 12.2123 18.8985 9.11258 20.1679 numMergedOcc 0
27 mol 58 unq 4 iso 0 dist 9.55426 6.31428 6.75888 10.3782 8.26899 8.80108 5.74871 7.21955 8.71468 10.8421 numMergedOcc 0
28 mol 59 unq 0 iso 0 dist 7.71095 6.71911 5.33688 5.3525 8.24062 6.5096 9.64444 6.73347 9.2902 7.0313 numMergedOcc 0
29 mol 100 unq 0 iso 0 dist 7.47343 8.72704 10.1589 15.209 7.75343 16.0363 10.6245 9.5074 6.0652 13.6642 numMergedOcc 0
30 mol 115 unq 0 iso 0 dist 9.33865 7.64585 10.2377 10.7942 7.76729 6.40036 6.40494 12.125 7.52142 9.65908 numMergedOcc 0
31 mol 115 unq 1 iso 0 dist 9.33865 7.76729 10.7942 6.09023 9.66954 12.4065 14.0688 13.3009 7.70313 16.4702 numMergedOcc 0
32 mol 115 unq 2 iso 0 dist 9.33865 7.76729 10.7942 10.2377 7.64585 6.40036 14.0688 13.3009 7.70313 5.67953 numMergedOcc 0
33 mol 115 unq 3 iso 0 dist 5.83991 7.76729 10.9739 6.09023 8.66155 12.4065 14.0688 17.0848 7.70313 16.4702 numMergedOcc 0
34 mol 115 unq 4 iso 0 dist 6.11741 7.64585 10.8939 10.8292 6.99777 17.3282 6.40494 12.2743 7.52142 16.9083 numMergedOcc 0
35 mol 115 unq 5 iso 0 dist 6.11741 7.64585 10.8939 6.12943 9.14376 12.1188 6.40494 12.2743 7.52142 7.76802 numMergedOcc 0
36 mol 115 unq 6 iso 0 dist 6.11741 6.99777 10.8292 4.61908 9.66954 9.9411 5.22052 11.0224 5.60389 6.20063 numMergedOcc 0
37 mol 115 unq 7 iso 0 dist 6.11741 6.99777 10.8292 10.8939 7.64585 17.3282 5.22052 11.0224 5.60389 15.3461 numMergedOcc 0
38 mol 115 unq 8 iso 0 dist 7.88312 6.99777 11.7126 4.61908 8.66155 9.9411 5.22052 12.13 5.60389 6.20063 numMergedOcc 0
39 mol 155 unq 0 iso 0 dist 6.23493 7.16254 6.3845 4.9093 9.17284 6.51096 10.4923 10.9606 9.0529 7.6506 numMergedOcc 0
40 mol 155 unq 1 iso 0 dist 6.23493 9.86313 5.86939 4.9093 9.17284 10.3514 11.0769 12.2416 9.80845 10.1521 numMergedOcc 0
41 mol 155 unq 2 iso 0 dist 6.23493 9.86313 5.86939 4.9093 9.17284 10.3514 10.4923 10.9606 7.55196 7.6506 numMergedOcc 0
42 mol 155 unq 3 iso 0 dist 7.46303 9.14392 6.3845 6.3437 9.17284 6.51096 6.89781 10.9606 9.0529 7.6506 numMergedOcc 0
43 mol 155 unq 4 iso 0 dist 7.46303 7.51198 5.86939 6.3437 9.17284 10.3514 5.50031 12.2416 9.80845 10.1521 numMergedOcc 0
44 mol 155 unq 5 iso 0 dist 7.46303 7.51198 5.86939 6.3437 9.17284 10.3514 6.89781 10.9606 7.55196 7.6506 numMergedOcc 0
45 mol 155 unq 6 iso 0 dist 6.43582 9.14392 12.1814 12.8482 9.38946 18.2998 6.89781 10.3161 9.0529 12.0574 numMergedOcc 0
46 mol 155 unq 7 iso 0 dist 6.43582 9.14392 12.1814 8.27726 7.36102 13.2154 6.89781 10.3161 9.0529 6.40403 numMergedOcc 0
47 mol 155 unq 8 iso 0 dist 6.43582 7.51198 6.34186 12.8482 9.38946 11.3251 5.50031 7.92304 9.80845 9.50478 numMergedOcc 0
48 mol 155 unq 9 iso 0 dist 6.43582 7.51198 6.34186 12.8482 9.38946 11.3251 6.89781 10.3161 7.55196 12.0574 numMergedOcc 0
49 mol 155 unq 10 iso 0 dist 6.43582 7.51198 6.34186 8.27726 7.36102 7.37901 5.50031 7.92304 9.80845 5.50045 numMergedOcc 0
50 mol 155 unq 11 iso 0 dist 6.43582 7.51198 6.34186 8.27726 7.36102 7.37901 6.89781 10.3161 7.55196 6.40403 numMergedOcc 0
51 mol 156 unq 0 iso 0 dist 7.44554 6.27641 7.29758 6.29785 9.36805 6.90155 5.4555 9.44367 5.81122 10.143 numMergedOcc 0
52 mol 156 unq 1 iso 0 dist 9.83699 6.27641 4.53931 6.29785 7.55203 6.90155 5.4555 10.3379 5.81122 10.143 numMergedOcc 0
53 mol 175 unq 0 iso 0 dist 9.0018 9.8589 8.22779 11.0415 9.31887 4.79852 8.29015 10.4182 5.4997 4.30489 numMergedOcc 0
54 mol 175 unq 1 iso 0 dist 9.0018 9.8589 8.22779 11.0415 9.31887 4.79852 14.7282 13.5281 6.99693 4.57622 numMergedOcc 0
55 mol 175 unq 2 iso 0 dist 7.652 7.24908 8.22779 5.0384 9.31887 4.79852 4.63177 10.4182 5.4997 4.30489 numMergedOcc 0
56 mol 175 unq 3 iso 0 dist 7.652 7.24908 8.22779 5.0384 9.31887 4.79852 9.30597 13.5281 6.99693 4.57622 numMergedOcc 0
57 mol 175 unq 4 iso 0 dist 5.6234 9.8589 10.5631 5.28109 9.0664 12.8738 8.29015 11.6765 5.4997 9.75742 numMergedOcc 0
58 mol 175 unq 5 iso 0 dist 5.6234 9.8589 10.5631 5.28109 9.0664 12.8738 14.7282 16.8306 6.99693 15.9867 numMergedOcc 0
59 mol 175 unq 6 iso 0 dist 9.92231 7.24908 10.5631 7.14477 9.0664 12.8738 4.63177 11.6765 5.4997 9.75742 numMergedOcc 0
60 mol 175 unq 7 iso 0 dist 9.92231 7.24908 10.5631 7.14477 9.0664 12.8738 9.30597 16.8306 6.99693 15.9867 numMergedOcc 0
61 mol 181 unq 0 iso 0 dist 5.98885 6.94688 5.86342 5.4601 7.20046 10.5561 6.6251 7.99195 9.06217 4.69841 numMergedOcc 0
62 mol 181 unq 1 iso 0 dist 5.98885 6.94688 5.86342 10.0524 7.13543 11.7007 6.6251 7.99195 9.06217 7.23063 numMergedOcc 0
63 mol 181 unq 2 iso 0 dist 5.98885 6.71012 9.14057 5.4601 7.20046 9.94131 6.6251 7.99195 7.13252 4.69841 numMergedOcc 0
64 mol 181 unq 3 iso 0 dist 5.98885 6.71012 9.14057 10.0524 7.13543 12.8673 6.6251 7.99195 7.13252 7.23063 numMergedOcc 0
65 mol 181 unq 4 iso 0 dist 5.98885 7.13543 10.0524 5.86342 6.94688 11.7007 5.77299 10.6908 6.32777 8.15174 numMergedOcc 0
66 mol 181 unq 5 iso 0 dist 5.98885 7.13543 10.0524 9.14057 6.71012 12.8673 5.77299 10.6908 6.32777 11.047 numMergedOcc 0
67 mol 181 unq 6 iso 0 dist 9.15386 6.94688 6.80228 8.25067 9.6668 8.20656 6.6251 12.8533 9.06217 14.048 numMergedOcc 0
68 mol 181 unq 7 iso 0 dist 9.15386 6.71012 11.6919 8.25067 9.6668 9.40622 6.6251 12.8533 7.13252 14.048 numMergedOcc 0
69 mol 181 unq 8 iso 0 dist 9.15386 9.6668 8.25067 6.80228 6.94688 8.20656 9.34211 8.90963 5.95304 4.43678 numMergedOcc 0
70 mol 181 unq 9 iso 0 dist 9.15386 9.6668 8.25067 11.6919 6.71012 9.40622 9.34211 8.90963 5.95304 6.03415 numMergedOcc 0
71 mol 181 unq 10 iso 0 dist 7.81386 4.93785 6.7991 9.53462 7.98142 12.2455 7.77758 5.94469 7.05653 8.93991 numMergedOcc 0
72 mol 181 unq 11 iso 0 dist 7.81386 4.93785 6.7991 11.1462 7.37327 11.691 7.77758 5.94469 7.05653 5.35588 numMergedOcc 0
73 mol 181 unq 12 iso 0 dist 7.81386 7.98142 9.53462 6.7991 4.93785 12.2455 5.63555 10.4943 5.97685 11.5017 numMergedOcc 0
74 mol 181 unq 13 iso 0 dist 7.81386 7.37327 11.1462 6.7991 4.93785 11.691 5.63555 10.4943 8.9289 11.5017 numMergedOcc 0
75 mol 181 unq 14 iso 0 dist 7.63312 7.98142 9.60512 4.80231 6.93764 10.7841 5.63555 5.9176 5.97685 5.60306 numMergedOcc 0
76 mol 181 unq 15 iso 0 dist 7.63312 7.37327 13.3389 4.80231 6.93764 11.1129 5.63555 5.9176 8.9289 5.60306 numMergedOcc 0
77 mol 235 unq 0 iso 0 dist 5.4638 9.58736 9.66021 4.65302 8.21247 11.9287 15.6327 16.5425 7.31773 16.5571 numMergedOcc 0
78 mol 235 unq 1 iso 0 dist 5.4638 8.21247 4.65302 9.66021 9.58736 11.9287 7.60081 9.55668 7.95766 13.128 numMergedOcc 0
79 mol 259 unq 0 iso 0 dist 5.30224 8.37865 5.31048 4.99891 6.77938 11.4462 8.75685 10.4552 8.71497 12.0428 numMergedOcc 0
80 mol 259 unq 1 iso 0 dist 5.30224 8.37865 5.31048 5.32839 7.76676 9.64797 8.75685 10.4552 8.71497 6.47089 numMergedOcc 0
81 mol 282 unq 0 iso 0 dist 8.04483 6.85028 6.3384 10.1236 8.8673 13.4504 7.80785 10.6906 6.8972 13.9326 numMergedOcc 0
82 mol 282 unq 1 iso 0 dist 6.33524 7.32347 6.3384 7.36881 8.8673 13.4504 6.6348 10.6906 6.8972 13.9326 numMergedOcc 0
