0 mol 0 unq 0 iso 0 dist 9.6994 9.23213 5.08793 5.24778 11.2072 8.34244 12.9149 12.5416 8.66548 8.73015 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.15528 9.23213 10.4498 5.24778 11.2263 8.34244 12.9149 15.8082 8.66548 8.73015 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 8.41585 6.36911 6.06176 5.03847 10.3148 9.97624 6.88805 5.99459 8.81608 5.5683 numMergedOcc 0
3 mol 7 unq 1 iso 0 dist 7.10621 9.36807 10.515 13.8829 8.72114 9.97624 13.156 9.67164 8.81608 5.5683 numMergedOcc 0
4 mol 45 unq 0 iso 0 dist 7.58835 9.20119 6.89191 10.7082 10.6216 5.55096 12.466 12.457 5.81001 4.06745 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 9.33865 7.64585 10.2377 6.40494 12.125 7.52142 6.95773 6.24825 7.65255 6.44969 numMergedOcc 0
6 mol 115 unq 1 iso 0 dist 9.33865 7.76729 10.7942 14.0688 13.3009 7.70313 6.63111 6.39384 8.0168 10.3264 numMergedOcc 0
7 mol 115 unq 2 iso 0 dist 5.83991 7.76729 10.9739 14.0688 17.0848 7.70313 6.63111 9.42082 8.0168 10.3264 numMergedOcc 0
8 mol 115 unq 3 iso 0 dist 6.11741 7.64585 10.8939 6.40494 12.2743 7.52142 6.95773 10.0255 7.65255 6.44969 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 8.73993 9.63176 10.6679 15.5019 17.9198 7.26955 6.9194 12.31 6.55202 10.3622 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 8.73993 9.63176 10.6679 15.5019 17.9198 7.26955 9.68677 7.64052 9.08536 14.9264 numMergedOcc 0
11 mol 119 unq 2 iso 0 dist 9.87172 7.44174 7.36192 10.314 14.2293 7.26955 12.4621 11.2897 6.55202 10.3622 numMergedOcc 0
12 mol 119 unq 3 iso 0 dist 9.87172 7.44174 7.36192 10.314 14.2293 7.26955 6.20019 6.99446 9.08536 14.9264 numMergedOcc 0
13 mol 126 unq 0 iso 0 dist 6.06638 7.75534 7.01257 6.0268 6.30546 7.36017 5.42561 8.96947 8.7789 3.9234 numMergedOcc 0
14 mol 126 unq 1 iso 0 dist 6.06638 7.75534 7.01257 6.0268 6.30546 7.36017 10.7549 11.4624 9.93613 5.50104 numMergedOcc 0
15 mol 126 unq 2 iso 0 dist 6.06638 7.75534 7.01257 8.01268 10.0699 5.14819 5.42561 8.96947 8.7789 6.1079 numMergedOcc 0
16 mol 126 unq 3 iso 0 dist 6.06638 7.75534 7.01257 8.01268 10.0699 5.14819 10.7549 11.4624 9.93613 7.02562 numMergedOcc 0
17 mol 126 unq 4 iso 0 dist 6.06638 7.75534 7.01257 10.2072 12.8712 6.84245 5.42561 8.96947 8.7789 9.58426 numMergedOcc 0
18 mol 126 unq 5 iso 0 dist 6.06638 7.75534 7.01257 10.2072 12.8712 6.84245 10.7549 11.4624 9.93613 11.1195 numMergedOcc 0
19 mol 133 unq 0 iso 0 dist 7.11802 7.92688 4.68409 5.92062 9.22661 6.51868 14.8533 13.5288 9.10003 10.0161 numMergedOcc 0
20 mol 133 unq 1 iso 0 dist 7.11802 7.92688 4.68409 6.61891 7.56378 7.34698 14.8533 13.5288 9.10003 11.7838 numMergedOcc 0
21 mol 133 unq 2 iso 0 dist 8.00618 7.92688 12.2037 5.92062 13.5028 6.51868 14.8533 20.9604 9.10003 10.0161 numMergedOcc 0
22 mol 133 unq 3 iso 0 dist 8.00618 7.92688 12.2037 6.61891 11.8433 7.34698 14.8533 20.9604 9.10003 11.7838 numMergedOcc 0
23 mol 181 unq 0 iso 0 dist 7.81386 4.93785 6.7991 7.77758 5.94469 7.05653 6.8757 6.64173 9.09234 4.98436 numMergedOcc 0
24 mol 181 unq 1 iso 0 dist 7.81386 4.93785 6.7991 7.77758 5.94469 7.05653 5.71898 9.01624 6.76746 11.9796 numMergedOcc 0
25 mol 181 unq 2 iso 0 dist 7.81386 4.93785 6.7991 7.77758 5.94469 7.05653 5.83796 9.55105 8.92098 12.3589 numMergedOcc 0
26 mol 227 unq 0 iso 0 dist 7.22101 8.17891 6.43754 10.9607 5.41321 7.57454 4.1511 9.91384 7.79951 12.8337 numMergedOcc 0
27 mol 227 unq 1 iso 0 dist 8.65997 6.95902 6.43754 9.72615 5.41321 7.57454 4.69247 9.91384 7.79951 12.8337 numMergedOcc 0
28 mol 227 unq 2 iso 0 dist 7.09863 8.17891 9.13836 10.9607 9.74265 7.57454 4.1511 10.3016 7.79951 12.8337 numMergedOcc 0
29 mol 234 unq 0 iso 0 dist 9.45496 9.5707 15.9563 10.0059 17.6227 7.43663 3.95629 11.1872 8.27411 11.1693 numMergedOcc 0
30 mol 234 unq 1 iso 0 dist 9.45496 9.5707 15.9563 10.0059 17.6227 7.43663 15.9732 20.7134 6.96257 10.7351 numMergedOcc 0
31 mol 234 unq 2 iso 0 dist 6.7625 9.5707 14.4106 10.0059 12.6238 7.43663 3.95629 10.5689 8.27411 11.1693 numMergedOcc 0
32 mol 234 unq 3 iso 0 dist 6.7625 9.5707 14.4106 10.0059 12.6238 7.43663 15.9732 19.3876 6.96257 10.7351 numMergedOcc 0
33 mol 235 unq 0 iso 0 dist 5.4638 9.58736 9.66021 15.6327 16.5425 7.31773 13.7306 13.8176 7.02029 5.4263 numMergedOcc 0
34 mol 259 unq 0 iso 0 dist 7.88519 7.48005 11.6195 8.81835 7.98231 8.71497 10.282 14.2242 8.84648 7.57379 numMergedOcc 0
35 mol 259 unq 1 iso 0 dist 7.88519 7.48005 11.6195 8.81835 7.98231 8.71497 10.067 10.3406 6.23661 4.47425 numMergedOcc 0
36 mol 259 unq 2 iso 0 dist 7.84554 7.48005 11.8736 8.81835 11.6972 8.71497 10.282 16.7322 8.84648 7.57379 numMergedOcc 0
37 mol 259 unq 3 iso 0 dist 7.84554 7.48005 11.8736 8.81835 11.6972 8.71497 10.067 12.8546 6.23661 4.47425 numMergedOcc 0
38 mol 259 unq 4 iso 0 dist 7.46176 7.48005 5.79468 8.81835 7.08526 8.71497 10.282 11.7465 8.84648 7.57379 numMergedOcc 0
39 mol 259 unq 5 iso 0 dist 7.46176 7.48005 5.79468 8.81835 7.08526 8.71497 10.067 5.85442 6.23661 4.47425 numMergedOcc 0
40 mol 259 unq 6 iso 0 dist 5.30224 8.37865 5.31048 8.75685 10.4552 8.71497 4.04513 8.03219 8.84648 7.57379 numMergedOcc 0
41 mol 259 unq 7 iso 0 dist 5.30224 8.37865 5.31048 8.75685 10.4552 8.71497 7.09907 6.9899 6.23661 4.47425 numMergedOcc 0
42 mol 259 unq 8 iso 0 dist 9.18903 7.48005 12.6649 8.81835 15.8414 8.71497 10.282 19.0182 8.84648 7.57379 numMergedOcc 0
43 mol 259 unq 9 iso 0 dist 9.18903 7.48005 12.6649 8.81835 15.8414 8.71497 10.067 16.0301 6.23661 4.47425 numMergedOcc 0
44 mol 282 unq 0 iso 0 dist 8.04483 6.85028 6.3384 7.80785 10.6906 6.8972 4.57104 10.2229 7.52924 4.10152 numMergedOcc 0
45 mol 282 unq 1 iso 0 dist 6.33524 7.32347 6.3384 6.6348 10.6906 6.8972 5.29852 10.2229 7.52924 4.10152 numMergedOcc 0
