0 mol 8 unq 0 iso 0 dist 9.91301 8.25051 9.62879 13.8883 9.01112 7.12261 7.46102 8.4069 8.96553 12.536 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 9.76968 4.2139 6.31718 5.36195 8.43054 4.65873 8.8641 6.92781 5.05803 6.57331 numMergedOcc 0
2 mol 16 unq 1 iso 0 dist 9.76968 12.1754 7.63133 5.36195 8.43054 9.81307 13.862 5.32694 5.46498 11.1513 numMergedOcc 0
3 mol 16 unq 2 iso 0 dist 9.76968 12.1754 7.63133 5.36195 8.43054 9.81307 19.1237 10.4155 8.71745 16.7405 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 6.11056 10.4744 8.86116 6.40447 8.09311 11.6226 14.4535 10.0952 6.86014 16.0162 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 6.11056 10.4744 8.86116 3.96014 9.05357 13.1949 14.4535 10.0952 6.86014 16.8554 numMergedOcc 0
6 mol 25 unq 0 iso 0 dist 7.63928 6.17631 6.03987 4.88495 7.99919 4.77954 9.87281 4.51512 7.31767 11.0249 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 6.36193 5.40367 6.62496 4.99692 9.22598 9.87158 9.01612 5.30792 6.86465 13.3281 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 6.36193 5.40367 6.62496 4.99692 9.22598 9.87158 4.88613 4.81926 6.35756 8.96727 numMergedOcc 0
9 mol 58 unq 2 iso 0 dist 4.88613 5.40367 6.35756 4.99692 8.96727 9.87158 9.01612 5.35073 6.86465 13.3281 numMergedOcc 0
10 mol 58 unq 3 iso 0 dist 4.88613 5.40367 6.35756 4.99692 8.96727 9.87158 6.36193 4.81926 6.62496 9.22598 numMergedOcc 0
11 mol 58 unq 4 iso 0 dist 4.88613 5.40367 6.35756 3.70586 8.01308 5.86526 9.01612 5.35073 6.86465 11.5155 numMergedOcc 0
12 mol 58 unq 5 iso 0 dist 4.88613 5.40367 6.35756 3.70586 8.01308 5.86526 6.36193 4.81926 6.62496 9.55996 numMergedOcc 0
13 mol 73 unq 0 iso 0 dist 6.18305 4.69583 6.19304 4.21749 8.68662 6.20232 11.0671 5.4148 9.96396 12.2276 numMergedOcc 0
14 mol 73 unq 1 iso 0 dist 6.18305 4.69583 6.19304 4.21749 8.68662 6.20232 13.2599 13.3558 8.70481 13.8931 numMergedOcc 0
15 mol 73 unq 2 iso 0 dist 6.18305 4.69583 6.19304 5.65986 7.4369 5.70116 11.0671 5.4148 9.96396 9.73086 numMergedOcc 0
16 mol 73 unq 3 iso 0 dist 6.18305 4.69583 6.19304 5.65986 7.4369 5.70116 13.2599 13.3558 8.70481 12.8207 numMergedOcc 0
17 mol 85 unq 0 iso 0 dist 6.58793 9.21014 6.19965 6.97936 7.7068 4.41789 10.7244 5.42586 7.97049 10.2413 numMergedOcc 0
18 mol 85 unq 1 iso 0 dist 6.58793 7.83419 7.66905 6.97936 7.7068 5.59906 10.7244 5.42586 7.47541 10.2413 numMergedOcc 0
19 mol 85 unq 2 iso 0 dist 6.58793 7.83419 7.66905 6.97936 7.7068 5.59906 11.7434 10.1164 5.73196 11.2056 numMergedOcc 0
20 mol 88 unq 0 iso 0 dist 9.72689 13.7794 9.36773 10.0429 7.80898 12.1193 11.4004 5.57085 8.31336 12.785 numMergedOcc 0
21 mol 88 unq 1 iso 0 dist 7.74197 4.0486 9.36773 11.151 7.80898 12.1193 7.86537 5.57085 8.31336 12.785 numMergedOcc 0
22 mol 95 unq 0 iso 0 dist 9.65047 5.69671 8.03644 8.55456 9.3948 11.3215 12.5791 16.6055 9.03572 19.7448 numMergedOcc 0
23 mol 95 unq 1 iso 0 dist 9.65047 5.69671 8.03644 8.55456 9.3948 11.3215 13.9545 13.8105 8.83255 19.9408 numMergedOcc 0
24 mol 95 unq 2 iso 0 dist 9.65047 5.69671 8.03644 3.84879 9.74607 5.06946 12.5791 16.6055 9.03572 11.97 numMergedOcc 0
25 mol 95 unq 3 iso 0 dist 9.65047 5.69671 8.03644 3.84879 9.74607 5.06946 13.9545 13.8105 8.83255 13.5721 numMergedOcc 0
26 mol 115 unq 0 iso 0 dist 9.35868 8.25001 7.30858 4.57067 6.04595 5.03039 14.0784 10.8507 5.83991 10.5599 numMergedOcc 0
27 mol 115 unq 1 iso 0 dist 9.35868 8.25001 7.30858 4.57067 6.04595 5.03039 13.3494 11.5723 7.88312 11.8378 numMergedOcc 0
28 mol 115 unq 2 iso 0 dist 5.02717 6.75472 5.83991 5.33827 7.69765 4.48636 12.5189 7.69052 9.33865 13.4105 numMergedOcc 0
29 mol 115 unq 3 iso 0 dist 5.02717 6.75472 5.83991 12.6105 9.42082 6.63111 12.5189 7.69052 9.33865 6.39384 numMergedOcc 0
30 mol 115 unq 4 iso 0 dist 5.02717 11.0268 7.88312 5.33827 7.69765 11.835 12.5189 7.69052 6.11741 13.4105 numMergedOcc 0
31 mol 115 unq 5 iso 0 dist 5.02717 11.0268 7.88312 12.6105 9.42082 6.07067 12.5189 7.69052 6.11741 6.39384 numMergedOcc 0
32 mol 117 unq 0 iso 0 dist 6.90827 10.4485 7.90328 5.61881 8.84018 7.20875 18.7881 13.1058 9.84395 16.804 numMergedOcc 0
33 mol 117 unq 1 iso 0 dist 8.90977 13.8755 7.90328 9.58747 8.84018 7.20875 20.7361 13.1058 9.84395 16.804 numMergedOcc 0
34 mol 127 unq 0 iso 0 dist 9.42513 8.60326 9.30299 8.71432 6.08673 12.8087 10.0998 7.30196 8.14887 12.1234 numMergedOcc 0
35 mol 129 unq 0 iso 0 dist 9.28278 14.5776 8.54584 9.05571 5.51197 12.1739 12.3446 4.61027 8.53613 9.97604 numMergedOcc 0
36 mol 129 unq 1 iso 0 dist 9.28278 14.5776 8.54584 14.5546 8.86944 5.63254 12.3446 4.61027 8.53613 11.1246 numMergedOcc 0
37 mol 129 unq 2 iso 0 dist 9.28278 14.5776 8.54584 9.63308 6.69691 8.26896 12.3446 4.61027 8.53613 10.5979 numMergedOcc 0
38 mol 133 unq 0 iso 0 dist 5.82404 5.37072 8.00618 11.5628 8.77023 15.0115 9.50322 8.18495 7.11802 12.5855 numMergedOcc 0
39 mol 134 unq 0 iso 0 dist 9.92932 10.5108 8.94367 3.76211 7.21868 8.06642 9.60411 5.49782 6.37586 7.93372 numMergedOcc 0
40 mol 134 unq 1 iso 0 dist 9.92932 10.5108 8.94367 3.76211 7.21868 8.06642 14.0674 8.80819 6.49416 11.988 numMergedOcc 0
41 mol 134 unq 2 iso 0 dist 9.92932 6.20443 9.86662 3.76211 7.21868 4.00092 9.60411 5.49782 9.71307 7.93372 numMergedOcc 0
42 mol 134 unq 3 iso 0 dist 9.60411 10.5108 6.37586 11.6349 9.33924 6.95573 9.92932 5.49782 8.94367 13.9752 numMergedOcc 0
43 mol 134 unq 4 iso 0 dist 9.60411 10.5108 6.37586 11.6349 9.33924 6.95573 14.0674 5.00817 6.49416 9.55584 numMergedOcc 0
44 mol 134 unq 5 iso 0 dist 9.60411 10.5108 6.37586 3.76211 7.93372 8.06642 9.92932 5.49782 8.94367 7.21868 numMergedOcc 0
45 mol 134 unq 6 iso 0 dist 9.60411 10.5108 6.37586 3.76211 7.93372 8.06642 14.0674 5.00817 6.49416 11.988 numMergedOcc 0
46 mol 134 unq 7 iso 0 dist 9.60411 6.20443 9.71307 11.6349 9.33924 10.2026 9.92932 5.49782 9.86662 13.9752 numMergedOcc 0
47 mol 134 unq 8 iso 0 dist 9.60411 6.20443 9.71307 3.76211 7.93372 4.00092 9.92932 5.49782 9.86662 7.21868 numMergedOcc 0
48 mol 134 unq 9 iso 0 dist 9.55556 11.9294 8.94367 4.63732 7.21868 8.06642 12.1043 5.49782 6.37586 7.93372 numMergedOcc 0
49 mol 134 unq 10 iso 0 dist 9.55556 11.9294 8.94367 4.63732 7.21868 8.06642 16.0579 8.80819 6.49416 11.988 numMergedOcc 0
50 mol 134 unq 11 iso 0 dist 9.55556 6.36794 9.86662 4.63732 7.21868 4.00092 12.1043 5.49782 9.71307 7.93372 numMergedOcc 0
51 mol 222 unq 0 iso 0 dist 7.85877 4.82768 7.21333 4.91709 5.56538 6.84862 10.8522 13.3522 8.01589 14.4477 numMergedOcc 0
52 mol 222 unq 1 iso 0 dist 7.85877 4.82768 7.21333 4.91709 5.56538 6.84862 10.0664 5.24516 7.7699 10.0233 numMergedOcc 0
53 mol 222 unq 2 iso 0 dist 7.85877 4.82768 7.21333 5.96186 7.48954 9.53117 10.8522 13.3522 8.01589 16.3082 numMergedOcc 0
54 mol 222 unq 3 iso 0 dist 7.85877 4.82768 7.21333 5.96186 7.48954 9.53117 10.0664 5.24516 7.7699 11.839 numMergedOcc 0
55 mol 229 unq 0 iso 0 dist 8.6537 10.7439 7.03423 3.72432 7.27993 7.22525 13.754 6.84129 9.06952 11.9869 numMergedOcc 0
56 mol 234 unq 0 iso 0 dist 7.86368 12.0816 9.45496 9.8663 7.81215 12.4252 12.3151 5.88703 6.56247 11.6391 numMergedOcc 0
57 mol 234 unq 1 iso 0 dist 7.86368 6.94762 6.7625 9.8663 7.81215 5.75498 12.3151 5.88703 9.36357 11.6391 numMergedOcc 0
58 mol 259 unq 0 iso 0 dist 5.90645 10.4985 8.13497 9.54522 9.07743 8.8603 9.73107 4.69778 7.88519 7.66153 numMergedOcc 0
59 mol 259 unq 1 iso 0 dist 8.06771 6.64729 8.13497 9.0675 9.46361 12.2293 12.3391 10.582 8.53687 18.7675 numMergedOcc 0
60 mol 259 unq 2 iso 0 dist 8.06771 9.79538 7.88519 9.0675 9.46361 11.6988 12.3795 4.86771 7.84554 12.8903 numMergedOcc 0
61 mol 259 unq 3 iso 0 dist 8.06771 9.79538 7.88519 9.0675 9.46361 11.6988 11.1503 6.96053 7.46176 6.95511 numMergedOcc 0
62 mol 259 unq 4 iso 0 dist 8.06771 9.79538 7.88519 9.0675 9.46361 11.6988 17.0226 10.4881 9.18903 17.104 numMergedOcc 0
63 mol 259 unq 5 iso 0 dist 9.54857 15.3806 7.46176 5.49348 5.85442 10.067 14.0139 6.96053 7.88519 10.3406 numMergedOcc 0
64 mol 259 unq 6 iso 0 dist 9.54857 15.3806 7.46176 5.49348 5.85442 10.067 16.6234 7.64658 7.84554 12.8546 numMergedOcc 0
65 mol 259 unq 7 iso 0 dist 9.54857 15.3806 7.46176 5.49348 5.85442 10.067 20.0172 10.5239 9.18903 16.0301 numMergedOcc 0
66 mol 259 unq 8 iso 0 dist 9.54857 15.3806 7.46176 5.13138 6.95511 11.6988 14.0139 6.96053 7.88519 9.46361 numMergedOcc 0
67 mol 259 unq 9 iso 0 dist 9.54857 15.3806 7.46176 5.13138 6.95511 11.6988 16.6234 7.64658 7.84554 12.8903 numMergedOcc 0
68 mol 259 unq 10 iso 0 dist 9.54857 15.3806 7.46176 5.13138 6.95511 11.6988 20.0172 10.5239 9.18903 17.104 numMergedOcc 0
69 mol 273 unq 0 iso 0 dist 8.57501 6.9795 6.92774 3.84082 9.21786 5.75897 11.7392 7.03728 9.01049 13.2256 numMergedOcc 0
70 mol 273 unq 1 iso 0 dist 8.57501 6.9795 6.92774 3.84082 9.21786 5.75897 15.145 8.55278 9.2983 14.5307 numMergedOcc 0
