0 mol 19 unq 0 iso 0 dist 8.4674 4.51865 5.80928 7.67038 4.54938 6.864 6.74265 9.58539 8.58657 5.5841 13.287 13.8916 13.0631 10.3056 8.19695 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 8.4674 4.51865 5.80928 7.67038 4.54938 6.864 6.74265 9.58539 8.58657 5.5841 8.40416 9.74255 7.08342 7.75618 7.02548 numMergedOcc 0
2 mol 19 unq 2 iso 0 dist 8.4674 4.51865 5.80928 10.3915 7.82074 11.0366 6.74265 9.58539 8.58657 7.42082 13.287 13.8916 13.0631 13.2054 8.19695 numMergedOcc 0
3 mol 19 unq 3 iso 0 dist 8.4674 4.51865 5.80928 10.3915 7.82074 11.0366 6.74265 9.58539 8.58657 7.42082 8.40416 9.74255 7.08342 12.3215 7.02548 numMergedOcc 0
4 mol 19 unq 4 iso 0 dist 8.4674 4.54938 7.67038 5.80928 4.51865 6.864 5.14627 6.20943 7.82528 4.69858 14.129 10.943 15.119 13.212 9.85134 numMergedOcc 0
5 mol 19 unq 5 iso 0 dist 8.4674 4.54938 7.67038 5.80928 4.51865 6.864 5.14627 6.20943 7.82528 4.69858 6.41575 4.64838 4.97119 6.41423 5.82366 numMergedOcc 0
6 mol 19 unq 6 iso 0 dist 4.54938 7.20519 7.34551 7.67038 8.4674 10.4091 5.5841 9.58539 9.80108 6.74265 10.3056 13.8916 9.32205 13.287 8.19695 numMergedOcc 0
7 mol 19 unq 7 iso 0 dist 4.54938 7.20519 7.34551 7.67038 8.4674 10.4091 5.5841 9.58539 9.80108 6.74265 7.75618 9.74255 4.96411 8.40416 7.02548 numMergedOcc 0
8 mol 19 unq 8 iso 0 dist 4.54938 7.20519 7.34551 5.03957 7.82074 12.1187 5.5841 9.58539 9.80108 7.42082 10.3056 13.8916 9.32205 13.2054 8.19695 numMergedOcc 0
9 mol 19 unq 9 iso 0 dist 4.54938 7.20519 7.34551 5.03957 7.82074 12.1187 5.5841 9.58539 9.80108 7.42082 7.75618 9.74255 4.96411 12.3215 7.02548 numMergedOcc 0
10 mol 19 unq 10 iso 0 dist 4.54938 6.864 5.80928 7.67038 8.4674 4.51865 5.5841 9.58539 8.58657 6.74265 10.3056 13.8916 13.0631 13.287 8.19695 numMergedOcc 0
11 mol 19 unq 11 iso 0 dist 4.54938 6.864 5.80928 7.67038 8.4674 4.51865 5.5841 9.58539 8.58657 6.74265 7.75618 9.74255 7.08342 8.40416 7.02548 numMergedOcc 0
12 mol 19 unq 12 iso 0 dist 4.54938 6.864 5.80928 5.03957 7.82074 11.0366 5.5841 9.58539 8.58657 7.42082 10.3056 13.8916 13.0631 13.2054 8.19695 numMergedOcc 0
13 mol 19 unq 13 iso 0 dist 4.54938 6.864 5.80928 5.03957 7.82074 11.0366 5.5841 9.58539 8.58657 7.42082 7.75618 9.74255 7.08342 12.3215 7.02548 numMergedOcc 0
14 mol 19 unq 14 iso 0 dist 4.54938 8.4674 7.67038 7.34551 7.20519 10.4091 5.14627 7.82528 6.20943 10.4988 14.129 15.119 10.943 19.7849 9.85134 numMergedOcc 0
15 mol 19 unq 15 iso 0 dist 4.54938 8.4674 7.67038 7.34551 7.20519 10.4091 5.14627 7.82528 6.20943 10.4988 6.41575 4.97119 4.64838 10.741 5.82366 numMergedOcc 0
16 mol 19 unq 16 iso 0 dist 4.54938 8.4674 7.67038 5.80928 6.864 4.51865 5.14627 7.82528 6.20943 4.69858 14.129 15.119 10.943 13.212 9.85134 numMergedOcc 0
17 mol 19 unq 17 iso 0 dist 4.54938 8.4674 7.67038 5.80928 6.864 4.51865 5.14627 7.82528 6.20943 4.69858 6.41575 4.97119 4.64838 6.41423 5.82366 numMergedOcc 0
18 mol 19 unq 18 iso 0 dist 4.51865 6.864 7.67038 5.80928 8.4674 4.54938 4.69858 6.20943 7.82528 5.14627 13.212 10.943 15.119 14.129 9.85134 numMergedOcc 0
19 mol 19 unq 19 iso 0 dist 4.51865 6.864 7.67038 5.80928 8.4674 4.54938 4.69858 6.20943 7.82528 5.14627 6.41423 4.64838 4.97119 6.41575 5.82366 numMergedOcc 0
20 mol 19 unq 20 iso 0 dist 6.864 7.20519 7.07775 7.67038 4.51865 10.4091 5.5841 8.58657 9.80108 6.74265 10.3056 13.0631 9.32205 13.287 8.19695 numMergedOcc 0
21 mol 19 unq 21 iso 0 dist 6.864 7.20519 7.07775 7.67038 4.51865 10.4091 5.5841 8.58657 9.80108 6.74265 7.75618 7.08342 4.96411 8.40416 7.02548 numMergedOcc 0
22 mol 19 unq 22 iso 0 dist 6.864 4.51865 7.67038 7.07775 7.20519 10.4091 4.69858 7.82528 6.20943 10.4988 13.212 15.119 10.943 19.7849 9.85134 numMergedOcc 0
23 mol 19 unq 23 iso 0 dist 6.864 4.51865 7.67038 7.07775 7.20519 10.4091 4.69858 7.82528 6.20943 10.4988 6.41423 4.97119 4.64838 10.741 5.82366 numMergedOcc 0
24 mol 19 unq 24 iso 0 dist 6.864 4.51865 7.67038 5.80928 4.54938 8.4674 4.69858 7.82528 6.20943 5.14627 13.212 15.119 10.943 14.129 9.85134 numMergedOcc 0
25 mol 19 unq 25 iso 0 dist 6.864 4.51865 7.67038 5.80928 4.54938 8.4674 4.69858 7.82528 6.20943 5.14627 6.41423 4.97119 4.64838 6.41575 5.82366 numMergedOcc 0
26 mol 45 unq 0 iso 0 dist 7.2846 7.58835 8.81358 5.24762 6.43774 11.2563 6.89191 12.1257 9.20119 9.01651 10.6216 12.8618 10.7082 10.862 5.55096 numMergedOcc 0
27 mol 58 unq 0 iso 0 dist 9.4099 6.64012 6.47414 10.6169 9.55426 13.4544 5.24906 9.73139 6.46761 13.1021 9.86039 12.2123 5.85698 18.8985 9.11258 numMergedOcc 0
28 mol 58 unq 1 iso 0 dist 9.4099 6.64012 6.47414 10.6169 9.55426 13.4544 5.11205 6.31428 7.58407 6.75888 12.3035 5.74871 11.387 7.21955 8.71468 numMergedOcc 0
29 mol 58 unq 2 iso 0 dist 9.55426 7.32874 5.90225 10.6169 9.4099 11.396 6.75888 6.31428 6.40841 5.11205 7.21955 5.74871 7.12541 12.3035 8.71468 numMergedOcc 0
30 mol 73 unq 0 iso 0 dist 9.96396 6.19304 5.4148 15.7123 9.38498 10.2049 7.41074 8.70133 4.65521 13.4082 9.24757 5.11416 6.56633 13.8696 7.10439 numMergedOcc 0
31 mol 73 unq 1 iso 0 dist 9.96396 6.19304 5.4148 12.016 9.75218 11.6369 7.41074 8.70133 4.65521 15.9882 9.24757 5.11416 6.56633 13.0145 7.10439 numMergedOcc 0
32 mol 100 unq 0 iso 0 dist 6.65086 7.47343 8.8807 5.88134 9.60661 12.0662 10.1589 10.5193 8.72704 10.1499 9.5074 6.71012 10.6245 9.1361 6.0652 numMergedOcc 0
33 mol 100 unq 1 iso 0 dist 6.56369 7.47343 12.6515 5.88134 9.35224 12.0662 10.1589 15.8984 8.72704 10.1499 9.5074 13.0596 10.6245 9.1361 6.0652 numMergedOcc 0
34 mol 115 unq 0 iso 0 dist 9.33865 6.11741 8.02349 7.69052 5.83991 7.88312 10.8292 13.9977 6.99777 11.7126 11.0224 11.8511 5.22052 12.13 5.60389 numMergedOcc 0
35 mol 115 unq 1 iso 0 dist 5.83991 7.88312 8.02349 7.69052 9.33865 6.11741 11.7126 13.9977 6.99777 10.8292 12.13 11.8511 5.22052 11.0224 5.60389 numMergedOcc 0
36 mol 115 unq 2 iso 0 dist 5.83991 9.33865 7.69052 10.8507 7.30858 13.8473 10.2377 12.2309 7.64585 19.2193 12.125 10.4285 6.40494 17.3799 7.52142 numMergedOcc 0
37 mol 115 unq 3 iso 0 dist 5.83991 9.33865 7.69052 8.02349 7.88312 6.11741 10.2377 12.2309 7.64585 10.8939 12.125 10.4285 6.40494 12.2743 7.52142 numMergedOcc 0
38 mol 115 unq 4 iso 0 dist 6.11741 9.33865 8.02349 7.69052 7.88312 5.83991 10.7942 12.9821 7.76729 10.9739 13.3009 16.1804 14.0688 17.0848 7.70313 numMergedOcc 0
39 mol 115 unq 5 iso 0 dist 7.88312 5.83991 8.02349 7.69052 6.11741 9.33865 10.9739 12.9821 7.76729 10.7942 17.0848 16.1804 14.0688 13.3009 7.70313 numMergedOcc 0
40 mol 115 unq 6 iso 0 dist 7.88312 6.11741 7.69052 11.5723 7.30858 13.8473 10.8939 12.2309 7.64585 19.2193 12.2743 10.4285 6.40494 17.3799 7.52142 numMergedOcc 0
41 mol 115 unq 7 iso 0 dist 7.88312 6.11741 7.69052 8.02349 5.83991 9.33865 10.8939 12.2309 7.64585 10.2377 12.2743 10.4285 6.40494 12.125 7.52142 numMergedOcc 0
42 mol 134 unq 0 iso 0 dist 8.94367 6.37586 5.49782 6.81259 9.86662 9.71307 5.41704 8.79571 5.42582 6.17103 6.23142 4.57832 5.29786 9.94764 8.73604 numMergedOcc 0
43 mol 134 unq 1 iso 0 dist 8.94367 6.49416 8.80819 6.81259 9.86662 12.5075 5.41704 8.79571 8.6355 6.17103 6.23142 4.57832 5.71679 9.94764 8.73604 numMergedOcc 0
44 mol 134 unq 2 iso 0 dist 6.37586 8.94367 5.49782 6.81259 9.71307 9.86662 5.41704 5.42582 8.79571 6.17103 6.23142 5.29786 4.57832 9.94764 8.73604 numMergedOcc 0
45 mol 134 unq 3 iso 0 dist 6.37586 6.49416 5.00817 6.81259 9.71307 12.5075 5.41704 5.42582 8.6355 6.17103 6.23142 5.29786 5.71679 9.94764 8.73604 numMergedOcc 0
46 mol 134 unq 4 iso 0 dist 6.49416 8.94367 8.80819 5.00526 6.54501 11.9139 5.41704 8.6355 8.79571 10.1448 6.23142 5.71679 4.57832 7.69991 8.73604 numMergedOcc 0
47 mol 134 unq 5 iso 0 dist 6.49416 6.37586 5.00817 5.00526 6.54501 9.5126 5.41704 8.6355 5.42582 10.1448 6.23142 5.71679 5.29786 7.69991 8.73604 numMergedOcc 0
48 mol 134 unq 6 iso 0 dist 9.86662 9.71307 5.49782 6.81259 8.94367 6.37586 6.17103 8.79571 5.42582 5.41704 9.94764 4.57832 5.29786 6.23142 8.73604 numMergedOcc 0
49 mol 134 unq 7 iso 0 dist 9.71307 9.86662 5.49782 6.81259 6.37586 8.94367 6.17103 5.42582 8.79571 5.41704 9.94764 5.29786 4.57832 6.23142 8.73604 numMergedOcc 0
50 mol 155 unq 0 iso 0 dist 7.46303 6.23493 5.71071 7.66392 6.43582 10.2463 6.3845 9.14392 7.16254 12.1814 10.9606 6.89781 10.4923 10.3161 9.0529 numMergedOcc 0
51 mol 155 unq 1 iso 0 dist 7.46303 6.23493 5.71071 7.66392 6.43582 10.2463 5.86939 7.51198 9.86313 6.34186 12.2416 5.50031 11.0769 7.92304 9.80845 numMergedOcc 0
52 mol 155 unq 2 iso 0 dist 7.46303 6.23493 5.71071 7.66392 6.43582 10.2463 5.86939 7.51198 9.86313 6.34186 10.9606 6.89781 10.4923 10.3161 7.55196 numMergedOcc 0
53 mol 175 unq 0 iso 0 dist 9.0018 7.652 7.42466 6.2715 5.6234 9.92231 8.22779 9.8589 7.24908 10.5631 10.4182 8.29015 4.63177 11.6765 5.4997 numMergedOcc 0
54 mol 175 unq 1 iso 0 dist 9.0018 7.652 7.42466 6.2715 5.6234 9.92231 8.22779 9.8589 7.24908 10.5631 13.5281 14.7282 9.30597 16.8306 6.99693 numMergedOcc 0
55 mol 175 unq 2 iso 0 dist 9.0018 7.652 7.42466 8.16421 6.57069 10.2623 8.22779 9.8589 7.24908 7.5414 10.4182 8.29015 4.63177 9.77896 5.4997 numMergedOcc 0
56 mol 175 unq 3 iso 0 dist 9.0018 7.652 7.42466 8.16421 6.57069 10.2623 8.22779 9.8589 7.24908 7.5414 13.5281 14.7282 9.30597 14.2813 6.99693 numMergedOcc 0
57 mol 175 unq 4 iso 0 dist 7.652 9.0018 7.42466 6.2715 9.92231 5.6234 8.22779 7.24908 9.8589 10.5631 10.4182 4.63177 8.29015 11.6765 5.4997 numMergedOcc 0
58 mol 175 unq 5 iso 0 dist 7.652 9.0018 7.42466 6.2715 9.92231 5.6234 8.22779 7.24908 9.8589 10.5631 13.5281 9.30597 14.7282 16.8306 6.99693 numMergedOcc 0
59 mol 175 unq 6 iso 0 dist 5.6234 9.92231 7.42466 6.2715 9.0018 7.652 10.5631 9.8589 7.24908 8.22779 11.6765 8.29015 4.63177 10.4182 5.4997 numMergedOcc 0
60 mol 175 unq 7 iso 0 dist 5.6234 9.92231 7.42466 6.2715 9.0018 7.652 10.5631 9.8589 7.24908 8.22779 16.8306 14.7282 9.30597 13.5281 6.99693 numMergedOcc 0
61 mol 175 unq 8 iso 0 dist 5.6234 9.92231 7.42466 5.35493 6.57069 10.2623 10.5631 9.8589 7.24908 7.5414 11.6765 8.29015 4.63177 9.77896 5.4997 numMergedOcc 0
62 mol 175 unq 9 iso 0 dist 5.6234 9.92231 7.42466 5.35493 6.57069 10.2623 10.5631 9.8589 7.24908 7.5414 16.8306 14.7282 9.30597 14.2813 6.99693 numMergedOcc 0
63 mol 175 unq 10 iso 0 dist 9.92231 5.6234 7.42466 6.2715 7.652 9.0018 10.5631 7.24908 9.8589 8.22779 11.6765 4.63177 8.29015 10.4182 5.4997 numMergedOcc 0
64 mol 175 unq 11 iso 0 dist 9.92231 5.6234 7.42466 6.2715 7.652 9.0018 10.5631 7.24908 9.8589 8.22779 16.8306 9.30597 14.7282 13.5281 6.99693 numMergedOcc 0
65 mol 181 unq 0 iso 0 dist 9.1374 5.98885 8.88798 13.2049 8.03334 10.7062 10.0524 10.7636 7.13543 7.07409 10.6908 8.04639 5.77299 6.59025 6.32777 numMergedOcc 0
66 mol 181 unq 1 iso 0 dist 9.1374 9.15386 12.1628 13.2049 8.03334 14.9794 8.25067 13.2702 9.6668 19.5806 8.90963 8.91338 9.34211 16.082 5.95304 numMergedOcc 0
67 mol 181 unq 2 iso 0 dist 5.98885 9.15386 5.16002 10.1912 9.09537 12.9862 8.25067 10.8351 9.6668 17.441 8.90963 9.81073 9.34211 18.0578 5.95304 numMergedOcc 0
68 mol 227 unq 0 iso 0 dist 7.22101 8.65997 5.22356 4.39704 7.09863 10.8157 6.43754 8.17891 6.95902 9.13836 5.41321 10.9607 9.72615 9.74265 7.57454 numMergedOcc 0
69 mol 227 unq 1 iso 0 dist 7.22101 7.55216 12.4689 4.39704 7.09863 10.0334 11.662 15.9414 8.83563 10.614 13.0798 15.6713 6.67321 14.1717 9.28891 numMergedOcc 0
70 mol 234 unq 0 iso 0 dist 6.56247 9.45496 5.88703 6.29886 8.34494 12.9605 15.9563 10.3388 9.5707 15.6589 17.6227 13.8349 10.0059 18.7983 7.43663 numMergedOcc 0
71 mol 234 unq 1 iso 0 dist 6.56247 9.45496 5.88703 7.82322 9.36357 6.7625 15.9563 10.3388 9.5707 14.4106 17.6227 13.8349 10.0059 12.6238 7.43663 numMergedOcc 0
72 mol 234 unq 2 iso 0 dist 9.36357 6.7625 5.88703 12.1694 8.34494 12.9605 14.4106 10.3388 9.5707 15.6589 12.6238 13.8349 10.0059 18.7983 7.43663 numMergedOcc 0
73 mol 234 unq 3 iso 0 dist 9.36357 6.7625 5.88703 7.82322 6.56247 9.45496 14.4106 10.3388 9.5707 15.9563 12.6238 13.8349 10.0059 17.6227 7.43663 numMergedOcc 0
74 mol 259 unq 0 iso 0 dist 8.13497 7.88519 4.69778 10.582 8.53687 10.5767 11.6195 10.9591 7.48005 17.9331 7.98231 8.41846 8.81835 15.5791 8.71497 numMergedOcc 0
