0 mol 19 unq 0 iso 0 dist 6.00439 7.83352 6.20943 10.8007 7.82528 7.67038 4.42145 9.85134 10.943 15.119 numMergedOcc 0
1 mol 19 unq 0 iso 1 dist 6.00439 10.8007 7.82528 7.83352 6.20943 7.67038 4.42145 9.85134 15.119 10.943 numMergedOcc 0
2 mol 19 unq 0 iso 2 dist 6.20943 7.83352 6.00439 7.67038 7.82528 10.8007 10.943 9.85134 4.42145 15.119 numMergedOcc 0
3 mol 19 unq 0 iso 3 dist 6.20943 7.67038 7.82528 7.83352 6.00439 10.8007 10.943 9.85134 15.119 4.42145 numMergedOcc 0
4 mol 19 unq 0 iso 4 dist 7.82528 10.8007 6.00439 7.67038 6.20943 7.83352 15.119 9.85134 4.42145 10.943 numMergedOcc 0
5 mol 19 unq 0 iso 5 dist 7.82528 7.67038 6.20943 10.8007 6.00439 7.83352 15.119 9.85134 10.943 4.42145 numMergedOcc 0
6 mol 19 unq 1 iso 0 dist 6.00439 7.83352 6.20943 10.8007 7.82528 7.67038 6.42867 5.82366 4.64838 4.97119 numMergedOcc 0
7 mol 19 unq 1 iso 1 dist 6.00439 10.8007 7.82528 7.83352 6.20943 7.67038 6.42867 5.82366 4.97119 4.64838 numMergedOcc 0
8 mol 19 unq 1 iso 2 dist 6.20943 7.83352 6.00439 7.67038 7.82528 10.8007 4.64838 5.82366 6.42867 4.97119 numMergedOcc 0
9 mol 19 unq 1 iso 3 dist 6.20943 7.67038 7.82528 7.83352 6.00439 10.8007 4.64838 5.82366 4.97119 6.42867 numMergedOcc 0
10 mol 19 unq 1 iso 4 dist 7.82528 10.8007 6.00439 7.67038 6.20943 7.83352 4.97119 5.82366 6.42867 4.64838 numMergedOcc 0
11 mol 19 unq 1 iso 5 dist 7.82528 7.67038 6.20943 10.8007 6.00439 7.83352 4.97119 5.82366 4.64838 6.42867 numMergedOcc 0
12 mol 58 unq 0 iso 0 dist 6.40841 11.0466 7.58407 5.90225 6.31428 6.47414 7.12541 8.71468 11.387 5.74871 numMergedOcc 0
13 mol 58 unq 0 iso 1 dist 6.40841 5.90225 6.31428 11.0466 7.58407 6.47414 7.12541 8.71468 5.74871 11.387 numMergedOcc 0
14 mol 58 unq 0 iso 2 dist 7.58407 11.0466 6.40841 6.47414 6.31428 5.90225 11.387 8.71468 7.12541 5.74871 numMergedOcc 0
15 mol 58 unq 0 iso 3 dist 7.58407 6.47414 6.31428 11.0466 6.40841 5.90225 11.387 8.71468 5.74871 7.12541 numMergedOcc 0
16 mol 58 unq 0 iso 4 dist 6.31428 5.90225 6.40841 6.47414 7.58407 11.0466 5.74871 8.71468 7.12541 11.387 numMergedOcc 0
17 mol 58 unq 0 iso 5 dist 6.31428 6.47414 7.58407 5.90225 6.40841 11.0466 5.74871 8.71468 11.387 7.12541 numMergedOcc 0
18 mol 58 unq 1 iso 0 dist 8.63333 5.35073 8.89374 10.8153 6.46761 8.62958 10.2049 9.11258 5.49591 5.85698 numMergedOcc 0
19 mol 58 unq 1 iso 1 dist 8.63333 10.8153 6.46761 5.35073 8.89374 8.62958 10.2049 9.11258 5.85698 5.49591 numMergedOcc 0
20 mol 58 unq 1 iso 2 dist 8.89374 5.35073 8.63333 8.62958 6.46761 10.8153 5.49591 9.11258 10.2049 5.85698 numMergedOcc 0
21 mol 58 unq 1 iso 3 dist 8.89374 8.62958 6.46761 5.35073 8.63333 10.8153 5.49591 9.11258 5.85698 10.2049 numMergedOcc 0
22 mol 58 unq 1 iso 4 dist 6.46761 10.8153 8.63333 8.62958 8.89374 5.35073 5.85698 9.11258 10.2049 5.49591 numMergedOcc 0
23 mol 58 unq 1 iso 5 dist 6.46761 8.62958 8.89374 10.8153 8.63333 5.35073 5.85698 9.11258 5.49591 10.2049 numMergedOcc 0
24 mol 58 unq 2 iso 0 dist 8.63333 5.35073 8.89374 14.5953 9.73139 14.176 10.2049 9.11258 5.49591 12.2123 numMergedOcc 0
25 mol 58 unq 2 iso 1 dist 8.63333 14.5953 9.73139 5.35073 8.89374 14.176 10.2049 9.11258 12.2123 5.49591 numMergedOcc 0
26 mol 58 unq 2 iso 2 dist 8.89374 5.35073 8.63333 14.176 9.73139 14.5953 5.49591 9.11258 10.2049 12.2123 numMergedOcc 0
27 mol 58 unq 2 iso 3 dist 8.89374 14.176 9.73139 5.35073 8.63333 14.5953 5.49591 9.11258 12.2123 10.2049 numMergedOcc 0
28 mol 58 unq 2 iso 4 dist 9.73139 14.5953 8.63333 14.176 8.89374 5.35073 12.2123 9.11258 10.2049 5.49591 numMergedOcc 0
29 mol 58 unq 2 iso 5 dist 9.73139 14.176 8.89374 14.5953 8.63333 5.35073 12.2123 9.11258 5.49591 10.2049 numMergedOcc 0
30 mol 58 unq 2 iso 0 dist 8.63333 10.8153 6.46761 14.5953 9.73139 6.47414 10.2049 9.11258 5.85698 12.2123 numMergedOcc 0
31 mol 58 unq 2 iso 1 dist 8.63333 14.5953 9.73139 10.8153 6.46761 6.47414 10.2049 9.11258 12.2123 5.85698 numMergedOcc 0
32 mol 58 unq 2 iso 2 dist 6.46761 10.8153 8.63333 6.47414 9.73139 14.5953 5.85698 9.11258 10.2049 12.2123 numMergedOcc 0
33 mol 58 unq 2 iso 3 dist 6.46761 6.47414 9.73139 10.8153 8.63333 14.5953 5.85698 9.11258 12.2123 10.2049 numMergedOcc 0
34 mol 58 unq 2 iso 4 dist 9.73139 14.5953 8.63333 6.47414 6.46761 10.8153 12.2123 9.11258 10.2049 5.85698 numMergedOcc 0
35 mol 58 unq 2 iso 5 dist 9.73139 6.47414 6.46761 14.5953 8.63333 10.8153 12.2123 9.11258 5.85698 10.2049 numMergedOcc 0
36 mol 58 unq 2 iso 0 dist 8.89374 8.62958 6.46761 14.176 9.73139 6.47414 5.49591 9.11258 5.85698 12.2123 numMergedOcc 0
37 mol 58 unq 2 iso 1 dist 8.89374 14.176 9.73139 8.62958 6.46761 6.47414 5.49591 9.11258 12.2123 5.85698 numMergedOcc 0
38 mol 58 unq 2 iso 2 dist 6.46761 8.62958 8.89374 6.47414 9.73139 14.176 5.85698 9.11258 5.49591 12.2123 numMergedOcc 0
39 mol 58 unq 2 iso 3 dist 6.46761 6.47414 9.73139 8.62958 8.89374 14.176 5.85698 9.11258 12.2123 5.49591 numMergedOcc 0
40 mol 58 unq 2 iso 4 dist 9.73139 14.176 8.89374 6.47414 6.46761 8.62958 12.2123 9.11258 5.49591 5.85698 numMergedOcc 0
41 mol 58 unq 2 iso 5 dist 9.73139 6.47414 6.46761 14.176 8.89374 8.62958 12.2123 9.11258 5.85698 5.49591 numMergedOcc 0
42 mol 73 unq 0 iso 0 dist 8.70133 7.4697 5.64598 5.4148 4.65521 5.7113 5.11416 7.10439 8.44406 6.56633 numMergedOcc 0
43 mol 73 unq 0 iso 1 dist 8.70133 5.4148 4.65521 7.4697 5.64598 5.7113 5.11416 7.10439 6.56633 8.44406 numMergedOcc 0
44 mol 73 unq 0 iso 2 dist 5.64598 7.4697 8.70133 5.7113 4.65521 5.4148 8.44406 7.10439 5.11416 6.56633 numMergedOcc 0
45 mol 73 unq 0 iso 3 dist 5.64598 5.7113 4.65521 7.4697 8.70133 5.4148 8.44406 7.10439 6.56633 5.11416 numMergedOcc 0
46 mol 73 unq 0 iso 4 dist 4.65521 5.4148 8.70133 5.7113 5.64598 7.4697 6.56633 7.10439 5.11416 8.44406 numMergedOcc 0
47 mol 73 unq 0 iso 5 dist 4.65521 5.7113 5.64598 5.4148 8.70133 7.4697 6.56633 7.10439 8.44406 5.11416 numMergedOcc 0
48 mol 92 unq 0 iso 0 dist 5.81965 5.02055 7.06013 8.95922 9.70512 12.4494 8.55834 7.1539 8.51055 7.76866 numMergedOcc 0
49 mol 92 unq 0 iso 1 dist 5.81965 8.95922 9.70512 5.02055 7.06013 12.4494 8.55834 7.1539 7.76866 8.51055 numMergedOcc 0
50 mol 92 unq 0 iso 2 dist 7.06013 5.02055 5.81965 12.4494 9.70512 8.95922 8.51055 7.1539 8.55834 7.76866 numMergedOcc 0
51 mol 92 unq 0 iso 3 dist 7.06013 12.4494 9.70512 5.02055 5.81965 8.95922 8.51055 7.1539 7.76866 8.55834 numMergedOcc 0
52 mol 92 unq 0 iso 4 dist 9.70512 8.95922 5.81965 12.4494 7.06013 5.02055 7.76866 7.1539 8.55834 8.51055 numMergedOcc 0
53 mol 92 unq 0 iso 5 dist 9.70512 12.4494 7.06013 8.95922 5.81965 5.02055 7.76866 7.1539 8.51055 8.55834 numMergedOcc 0
54 mol 92 unq 1 iso 0 dist 5.81965 5.02055 7.06013 8.95922 9.70512 12.4494 9.50382 5.39745 11.3858 7.56363 numMergedOcc 0
55 mol 92 unq 1 iso 1 dist 5.81965 8.95922 9.70512 5.02055 7.06013 12.4494 9.50382 5.39745 7.56363 11.3858 numMergedOcc 0
56 mol 92 unq 1 iso 2 dist 7.06013 5.02055 5.81965 12.4494 9.70512 8.95922 11.3858 5.39745 9.50382 7.56363 numMergedOcc 0
57 mol 92 unq 1 iso 3 dist 7.06013 12.4494 9.70512 5.02055 5.81965 8.95922 11.3858 5.39745 7.56363 9.50382 numMergedOcc 0
58 mol 92 unq 1 iso 4 dist 9.70512 8.95922 5.81965 12.4494 7.06013 5.02055 7.56363 5.39745 9.50382 11.3858 numMergedOcc 0
59 mol 92 unq 1 iso 5 dist 9.70512 12.4494 7.06013 8.95922 5.81965 5.02055 7.56363 5.39745 11.3858 9.50382 numMergedOcc 0
60 mol 119 unq 0 iso 0 dist 7.39889 11.6667 9.63176 11.3169 7.44174 12.4603 5.92984 7.26955 15.5019 10.314 numMergedOcc 0
61 mol 119 unq 0 iso 1 dist 7.39889 11.3169 7.44174 11.6667 9.63176 12.4603 5.92984 7.26955 10.314 15.5019 numMergedOcc 0
62 mol 119 unq 0 iso 2 dist 9.63176 11.6667 7.39889 12.4603 7.44174 11.3169 15.5019 7.26955 5.92984 10.314 numMergedOcc 0
63 mol 119 unq 0 iso 3 dist 9.63176 12.4603 7.44174 11.6667 7.39889 11.3169 15.5019 7.26955 10.314 5.92984 numMergedOcc 0
64 mol 119 unq 0 iso 4 dist 7.44174 11.3169 7.39889 12.4603 9.63176 11.6667 10.314 7.26955 5.92984 15.5019 numMergedOcc 0
65 mol 119 unq 0 iso 5 dist 7.44174 12.4603 9.63176 11.3169 7.39889 11.6667 10.314 7.26955 15.5019 5.92984 numMergedOcc 0
66 mol 134 unq 0 iso 0 dist 8.79571 5.49782 5.42582 8.80819 8.6355 5.00817 4.57832 8.73604 5.29786 5.71679 numMergedOcc 0
67 mol 134 unq 0 iso 1 dist 8.79571 8.80819 8.6355 5.49782 5.42582 5.00817 4.57832 8.73604 5.71679 5.29786 numMergedOcc 0
68 mol 134 unq 0 iso 2 dist 5.42582 5.49782 8.79571 5.00817 8.6355 8.80819 5.29786 8.73604 4.57832 5.71679 numMergedOcc 0
69 mol 134 unq 0 iso 3 dist 5.42582 5.00817 8.6355 5.49782 8.79571 8.80819 5.29786 8.73604 5.71679 4.57832 numMergedOcc 0
70 mol 134 unq 0 iso 4 dist 8.6355 8.80819 8.79571 5.00817 5.42582 5.49782 5.71679 8.73604 4.57832 5.29786 numMergedOcc 0
71 mol 134 unq 0 iso 5 dist 8.6355 5.00817 5.42582 8.80819 8.79571 5.49782 5.71679 8.73604 5.29786 4.57832 numMergedOcc 0
72 mol 173 unq 0 iso 0 dist 7.93331 4.83994 6.98095 5.16343 8.31897 8.17887 6.14414 8.41245 5.27321 10.8609 numMergedOcc 0
73 mol 173 unq 0 iso 1 dist 7.93331 5.16343 8.31897 4.83994 6.98095 8.17887 6.14414 8.41245 10.8609 5.27321 numMergedOcc 0
74 mol 173 unq 0 iso 2 dist 6.98095 4.83994 7.93331 8.17887 8.31897 5.16343 5.27321 8.41245 6.14414 10.8609 numMergedOcc 0
75 mol 173 unq 0 iso 3 dist 6.98095 8.17887 8.31897 4.83994 7.93331 5.16343 5.27321 8.41245 10.8609 6.14414 numMergedOcc 0
76 mol 173 unq 0 iso 4 dist 8.31897 5.16343 7.93331 8.17887 6.98095 4.83994 10.8609 8.41245 6.14414 5.27321 numMergedOcc 0
77 mol 173 unq 0 iso 5 dist 8.31897 8.17887 6.98095 5.16343 7.93331 4.83994 10.8609 8.41245 5.27321 6.14414 numMergedOcc 0
78 mol 173 unq 1 iso 0 dist 7.93331 4.83994 6.98095 5.16343 8.31897 8.17887 4.72839 6.64779 8.07089 5.70743 numMergedOcc 0
79 mol 173 unq 1 iso 1 dist 7.93331 5.16343 8.31897 4.83994 6.98095 8.17887 4.72839 6.64779 5.70743 8.07089 numMergedOcc 0
80 mol 173 unq 1 iso 2 dist 6.98095 4.83994 7.93331 8.17887 8.31897 5.16343 8.07089 6.64779 4.72839 5.70743 numMergedOcc 0
81 mol 173 unq 1 iso 3 dist 6.98095 8.17887 8.31897 4.83994 7.93331 5.16343 8.07089 6.64779 5.70743 4.72839 numMergedOcc 0
82 mol 173 unq 1 iso 4 dist 8.31897 5.16343 7.93331 8.17887 6.98095 4.83994 5.70743 6.64779 4.72839 8.07089 numMergedOcc 0
83 mol 173 unq 1 iso 5 dist 8.31897 8.17887 6.98095 5.16343 7.93331 4.83994 5.70743 6.64779 8.07089 4.72839 numMergedOcc 0
84 mol 194 unq 0 iso 0 dist 6.95408 8.2172 9.57538 10.5623 9.2285 4.53419 5.43725 9.86703 10.0597 13.5246 numMergedOcc 0
85 mol 194 unq 0 iso 1 dist 6.95408 10.5623 9.2285 8.2172 9.57538 4.53419 5.43725 9.86703 13.5246 10.0597 numMergedOcc 0
86 mol 194 unq 0 iso 2 dist 9.57538 8.2172 6.95408 4.53419 9.2285 10.5623 10.0597 9.86703 5.43725 13.5246 numMergedOcc 0
87 mol 194 unq 0 iso 3 dist 9.57538 4.53419 9.2285 8.2172 6.95408 10.5623 10.0597 9.86703 13.5246 5.43725 numMergedOcc 0
88 mol 194 unq 0 iso 4 dist 9.2285 10.5623 6.95408 4.53419 9.57538 8.2172 13.5246 9.86703 5.43725 10.0597 numMergedOcc 0
89 mol 194 unq 0 iso 5 dist 9.2285 4.53419 9.57538 10.5623 6.95408 8.2172 13.5246 9.86703 10.0597 5.43725 numMergedOcc 0
90 mol 194 unq 1 iso 0 dist 6.95408 8.2172 9.57538 11.7618 7.58278 8.12479 5.43725 9.86703 10.0597 14.8824 numMergedOcc 0
91 mol 194 unq 1 iso 1 dist 6.95408 11.7618 7.58278 8.2172 9.57538 8.12479 5.43725 9.86703 14.8824 10.0597 numMergedOcc 0
92 mol 194 unq 1 iso 2 dist 9.57538 8.2172 6.95408 8.12479 7.58278 11.7618 10.0597 9.86703 5.43725 14.8824 numMergedOcc 0
93 mol 194 unq 1 iso 3 dist 9.57538 8.12479 7.58278 8.2172 6.95408 11.7618 10.0597 9.86703 14.8824 5.43725 numMergedOcc 0
94 mol 194 unq 1 iso 4 dist 7.58278 11.7618 6.95408 8.12479 9.57538 8.2172 14.8824 9.86703 5.43725 10.0597 numMergedOcc 0
95 mol 194 unq 1 iso 5 dist 7.58278 8.12479 9.57538 11.7618 6.95408 8.2172 14.8824 9.86703 10.0597 5.43725 numMergedOcc 0
96 mol 194 unq 1 iso 0 dist 6.95408 10.5623 9.2285 11.7618 7.58278 4.40125 5.43725 9.86703 13.5246 14.8824 numMergedOcc 0
97 mol 194 unq 1 iso 1 dist 6.95408 11.7618 7.58278 10.5623 9.2285 4.40125 5.43725 9.86703 14.8824 13.5246 numMergedOcc 0
98 mol 194 unq 1 iso 2 dist 9.2285 10.5623 6.95408 4.40125 7.58278 11.7618 13.5246 9.86703 5.43725 14.8824 numMergedOcc 0
99 mol 194 unq 1 iso 3 dist 9.2285 4.40125 7.58278 10.5623 6.95408 11.7618 13.5246 9.86703 14.8824 5.43725 numMergedOcc 0
100 mol 194 unq 1 iso 4 dist 7.58278 11.7618 6.95408 4.40125 9.2285 10.5623 14.8824 9.86703 5.43725 13.5246 numMergedOcc 0
101 mol 194 unq 1 iso 5 dist 7.58278 4.40125 9.2285 11.7618 6.95408 10.5623 14.8824 9.86703 13.5246 5.43725 numMergedOcc 0
102 mol 194 unq 1 iso 0 dist 9.57538 4.53419 9.2285 8.12479 7.58278 4.40125 10.0597 9.86703 13.5246 14.8824 numMergedOcc 0
103 mol 194 unq 1 iso 1 dist 9.57538 8.12479 7.58278 4.53419 9.2285 4.40125 10.0597 9.86703 14.8824 13.5246 numMergedOcc 0
104 mol 194 unq 1 iso 2 dist 9.2285 4.53419 9.57538 4.40125 7.58278 8.12479 13.5246 9.86703 10.0597 14.8824 numMergedOcc 0
105 mol 194 unq 1 iso 3 dist 9.2285 4.40125 7.58278 4.53419 9.57538 8.12479 13.5246 9.86703 14.8824 10.0597 numMergedOcc 0
106 mol 194 unq 1 iso 4 dist 7.58278 8.12479 9.57538 4.40125 9.2285 4.53419 14.8824 9.86703 10.0597 13.5246 numMergedOcc 0
107 mol 194 unq 1 iso 5 dist 7.58278 4.40125 9.2285 8.12479 9.57538 4.53419 14.8824 9.86703 13.5246 10.0597 numMergedOcc 0
108 mol 235 unq 0 iso 0 dist 9.58736 9.85037 9.43058 13.6669 8.75735 5.52217 15.6327 7.31773 10.632 6.01041 numMergedOcc 0
109 mol 235 unq 0 iso 1 dist 9.58736 13.6669 8.75735 9.85037 9.43058 5.52217 15.6327 7.31773 6.01041 10.632 numMergedOcc 0
110 mol 235 unq 0 iso 2 dist 9.43058 9.85037 9.58736 5.52217 8.75735 13.6669 10.632 7.31773 15.6327 6.01041 numMergedOcc 0
111 mol 235 unq 0 iso 3 dist 9.43058 5.52217 8.75735 9.85037 9.58736 13.6669 10.632 7.31773 6.01041 15.6327 numMergedOcc 0
112 mol 235 unq 0 iso 4 dist 8.75735 13.6669 9.58736 5.52217 9.43058 9.85037 6.01041 7.31773 15.6327 10.632 numMergedOcc 0
113 mol 235 unq 0 iso 5 dist 8.75735 5.52217 9.43058 13.6669 9.58736 9.85037 6.01041 7.31773 10.632 15.6327 numMergedOcc 0
114 mol 235 unq 1 iso 0 dist 9.58736 9.85037 9.43058 16.4493 6.98084 14.4362 15.6327 7.31773 10.632 6.82855 numMergedOcc 0
115 mol 235 unq 1 iso 1 dist 9.58736 16.4493 6.98084 9.85037 9.43058 14.4362 15.6327 7.31773 6.82855 10.632 numMergedOcc 0
116 mol 235 unq 1 iso 2 dist 9.43058 9.85037 9.58736 14.4362 6.98084 16.4493 10.632 7.31773 15.6327 6.82855 numMergedOcc 0
117 mol 235 unq 1 iso 3 dist 9.43058 14.4362 6.98084 9.85037 9.58736 16.4493 10.632 7.31773 6.82855 15.6327 numMergedOcc 0
118 mol 235 unq 1 iso 4 dist 6.98084 16.4493 9.58736 14.4362 9.43058 9.85037 6.82855 7.31773 15.6327 10.632 numMergedOcc 0
119 mol 235 unq 1 iso 5 dist 6.98084 14.4362 9.43058 16.4493 9.58736 9.85037 6.82855 7.31773 10.632 15.6327 numMergedOcc 0
120 mol 235 unq 2 iso 0 dist 9.58736 9.85037 9.43058 15.4 7.32211 14.4107 15.6327 7.31773 10.632 6.46722 numMergedOcc 0
121 mol 235 unq 2 iso 1 dist 9.58736 15.4 7.32211 9.85037 9.43058 14.4107 15.6327 7.31773 6.46722 10.632 numMergedOcc 0
122 mol 235 unq 2 iso 2 dist 9.43058 9.85037 9.58736 14.4107 7.32211 15.4 10.632 7.31773 15.6327 6.46722 numMergedOcc 0
123 mol 235 unq 2 iso 3 dist 9.43058 14.4107 7.32211 9.85037 9.58736 15.4 10.632 7.31773 6.46722 15.6327 numMergedOcc 0
124 mol 235 unq 2 iso 4 dist 7.32211 15.4 9.58736 14.4107 9.43058 9.85037 6.46722 7.31773 15.6327 10.632 numMergedOcc 0
125 mol 235 unq 2 iso 5 dist 7.32211 14.4107 9.43058 15.4 9.58736 9.85037 6.46722 7.31773 10.632 15.6327 numMergedOcc 0
126 mol 235 unq 1 iso 0 dist 9.58736 13.6669 8.75735 16.4493 6.98084 11.3519 15.6327 7.31773 6.01041 6.82855 numMergedOcc 0
127 mol 235 unq 1 iso 1 dist 9.58736 16.4493 6.98084 13.6669 8.75735 11.3519 15.6327 7.31773 6.82855 6.01041 numMergedOcc 0
128 mol 235 unq 1 iso 2 dist 8.75735 13.6669 9.58736 11.3519 6.98084 16.4493 6.01041 7.31773 15.6327 6.82855 numMergedOcc 0
129 mol 235 unq 1 iso 3 dist 8.75735 11.3519 6.98084 13.6669 9.58736 16.4493 6.01041 7.31773 6.82855 15.6327 numMergedOcc 0
130 mol 235 unq 1 iso 4 dist 6.98084 16.4493 9.58736 11.3519 8.75735 13.6669 6.82855 7.31773 15.6327 6.01041 numMergedOcc 0
131 mol 235 unq 1 iso 5 dist 6.98084 11.3519 8.75735 16.4493 9.58736 13.6669 6.82855 7.31773 6.01041 15.6327 numMergedOcc 0
132 mol 235 unq 2 iso 0 dist 9.58736 13.6669 8.75735 15.4 7.32211 11.3789 15.6327 7.31773 6.01041 6.46722 numMergedOcc 0
133 mol 235 unq 2 iso 1 dist 9.58736 15.4 7.32211 13.6669 8.75735 11.3789 15.6327 7.31773 6.46722 6.01041 numMergedOcc 0
134 mol 235 unq 2 iso 2 dist 8.75735 13.6669 9.58736 11.3789 7.32211 15.4 6.01041 7.31773 15.6327 6.46722 numMergedOcc 0
135 mol 235 unq 2 iso 3 dist 8.75735 11.3789 7.32211 13.6669 9.58736 15.4 6.01041 7.31773 6.46722 15.6327 numMergedOcc 0
136 mol 235 unq 2 iso 4 dist 7.32211 15.4 9.58736 11.3789 8.75735 13.6669 6.46722 7.31773 15.6327 6.01041 numMergedOcc 0
137 mol 235 unq 2 iso 5 dist 7.32211 11.3789 8.75735 15.4 9.58736 13.6669 6.46722 7.31773 6.01041 15.6327 numMergedOcc 0
138 mol 235 unq 2 iso 0 dist 9.58736 16.4493 6.98084 15.4 7.32211 7.218 15.6327 7.31773 6.82855 6.46722 numMergedOcc 0
139 mol 235 unq 2 iso 1 dist 9.58736 15.4 7.32211 16.4493 6.98084 7.218 15.6327 7.31773 6.46722 6.82855 numMergedOcc 0
140 mol 235 unq 2 iso 2 dist 6.98084 16.4493 9.58736 7.218 7.32211 15.4 6.82855 7.31773 15.6327 6.46722 numMergedOcc 0
141 mol 235 unq 2 iso 3 dist 6.98084 7.218 7.32211 16.4493 9.58736 15.4 6.82855 7.31773 6.46722 15.6327 numMergedOcc 0
142 mol 235 unq 2 iso 4 dist 7.32211 15.4 9.58736 7.218 6.98084 16.4493 6.46722 7.31773 15.6327 6.82855 numMergedOcc 0
143 mol 235 unq 2 iso 5 dist 7.32211 7.218 6.98084 15.4 9.58736 16.4493 6.46722 7.31773 6.82855 15.6327 numMergedOcc 0
144 mol 235 unq 1 iso 0 dist 9.43058 5.52217 8.75735 14.4362 6.98084 11.3519 10.632 7.31773 6.01041 6.82855 numMergedOcc 0
145 mol 235 unq 1 iso 1 dist 9.43058 14.4362 6.98084 5.52217 8.75735 11.3519 10.632 7.31773 6.82855 6.01041 numMergedOcc 0
146 mol 235 unq 1 iso 2 dist 8.75735 5.52217 9.43058 11.3519 6.98084 14.4362 6.01041 7.31773 10.632 6.82855 numMergedOcc 0
147 mol 235 unq 1 iso 3 dist 8.75735 11.3519 6.98084 5.52217 9.43058 14.4362 6.01041 7.31773 6.82855 10.632 numMergedOcc 0
148 mol 235 unq 1 iso 4 dist 6.98084 14.4362 9.43058 11.3519 8.75735 5.52217 6.82855 7.31773 10.632 6.01041 numMergedOcc 0
149 mol 235 unq 1 iso 5 dist 6.98084 11.3519 8.75735 14.4362 9.43058 5.52217 6.82855 7.31773 6.01041 10.632 numMergedOcc 0
150 mol 235 unq 2 iso 0 dist 9.43058 5.52217 8.75735 14.4107 7.32211 11.3789 10.632 7.31773 6.01041 6.46722 numMergedOcc 0
151 mol 235 unq 2 iso 1 dist 9.43058 14.4107 7.32211 5.52217 8.75735 11.3789 10.632 7.31773 6.46722 6.01041 numMergedOcc 0
152 mol 235 unq 2 iso 2 dist 8.75735 5.52217 9.43058 11.3789 7.32211 14.4107 6.01041 7.31773 10.632 6.46722 numMergedOcc 0
153 mol 235 unq 2 iso 3 dist 8.75735 11.3789 7.32211 5.52217 9.43058 14.4107 6.01041 7.31773 6.46722 10.632 numMergedOcc 0
154 mol 235 unq 2 iso 4 dist 7.32211 14.4107 9.43058 11.3789 8.75735 5.52217 6.46722 7.31773 10.632 6.01041 numMergedOcc 0
155 mol 235 unq 2 iso 5 dist 7.32211 11.3789 8.75735 14.4107 9.43058 5.52217 6.46722 7.31773 6.01041 10.632 numMergedOcc 0
156 mol 235 unq 2 iso 0 dist 9.43058 14.4362 6.98084 14.4107 7.32211 7.218 10.632 7.31773 6.82855 6.46722 numMergedOcc 0
157 mol 235 unq 2 iso 1 dist 9.43058 14.4107 7.32211 14.4362 6.98084 7.218 10.632 7.31773 6.46722 6.82855 numMergedOcc 0
158 mol 235 unq 2 iso 2 dist 6.98084 14.4362 9.43058 7.218 7.32211 14.4107 6.82855 7.31773 10.632 6.46722 numMergedOcc 0
159 mol 235 unq 2 iso 3 dist 6.98084 7.218 7.32211 14.4362 9.43058 14.4107 6.82855 7.31773 6.46722 10.632 numMergedOcc 0
160 mol 235 unq 2 iso 4 dist 7.32211 14.4107 9.43058 7.218 6.98084 14.4362 6.46722 7.31773 10.632 6.82855 numMergedOcc 0
161 mol 235 unq 2 iso 5 dist 7.32211 7.218 6.98084 14.4107 9.43058 14.4362 6.46722 7.31773 6.82855 10.632 numMergedOcc 0
162 mol 235 unq 2 iso 0 dist 8.75735 11.3519 6.98084 11.3789 7.32211 7.218 6.01041 7.31773 6.82855 6.46722 numMergedOcc 0
163 mol 235 unq 2 iso 1 dist 8.75735 11.3789 7.32211 11.3519 6.98084 7.218 6.01041 7.31773 6.46722 6.82855 numMergedOcc 0
164 mol 235 unq 2 iso 2 dist 6.98084 11.3519 8.75735 7.218 7.32211 11.3789 6.82855 7.31773 6.01041 6.46722 numMergedOcc 0
165 mol 235 unq 2 iso 3 dist 6.98084 7.218 7.32211 11.3519 8.75735 11.3789 6.82855 7.31773 6.46722 6.01041 numMergedOcc 0
166 mol 235 unq 2 iso 4 dist 7.32211 11.3789 8.75735 7.218 6.98084 11.3519 6.46722 7.31773 6.01041 6.82855 numMergedOcc 0
167 mol 235 unq 2 iso 5 dist 7.32211 7.218 6.98084 11.3789 8.75735 11.3519 6.46722 7.31773 6.82855 6.01041 numMergedOcc 0
168 mol 238 unq 0 iso 0 dist 6.05141 5.6348 8.09066 8.87326 7.2766 5.31152 10.7081 8.09718 12.2874 10.4017 numMergedOcc 0
169 mol 238 unq 0 iso 1 dist 6.05141 8.87326 7.2766 5.6348 8.09066 5.31152 10.7081 8.09718 10.4017 12.2874 numMergedOcc 0
170 mol 238 unq 0 iso 2 dist 8.09066 5.6348 6.05141 5.31152 7.2766 8.87326 12.2874 8.09718 10.7081 10.4017 numMergedOcc 0
171 mol 238 unq 0 iso 3 dist 8.09066 5.31152 7.2766 5.6348 6.05141 8.87326 12.2874 8.09718 10.4017 10.7081 numMergedOcc 0
172 mol 238 unq 0 iso 4 dist 7.2766 8.87326 6.05141 5.31152 8.09066 5.6348 10.4017 8.09718 10.7081 12.2874 numMergedOcc 0
173 mol 238 unq 0 iso 5 dist 7.2766 5.31152 8.09066 8.87326 6.05141 5.6348 10.4017 8.09718 12.2874 10.7081 numMergedOcc 0
174 mol 238 unq 1 iso 0 dist 6.05141 5.6348 8.09066 8.87326 7.2766 5.31152 5.50308 6.73446 7.11984 7.95232 numMergedOcc 0
175 mol 238 unq 1 iso 1 dist 6.05141 8.87326 7.2766 5.6348 8.09066 5.31152 5.50308 6.73446 7.95232 7.11984 numMergedOcc 0
176 mol 238 unq 1 iso 2 dist 8.09066 5.6348 6.05141 5.31152 7.2766 8.87326 7.11984 6.73446 5.50308 7.95232 numMergedOcc 0
177 mol 238 unq 1 iso 3 dist 8.09066 5.31152 7.2766 5.6348 6.05141 8.87326 7.11984 6.73446 7.95232 5.50308 numMergedOcc 0
178 mol 238 unq 1 iso 4 dist 7.2766 8.87326 6.05141 5.31152 8.09066 5.6348 7.95232 6.73446 5.50308 7.11984 numMergedOcc 0
179 mol 238 unq 1 iso 5 dist 7.2766 5.31152 8.09066 8.87326 6.05141 5.6348 7.95232 6.73446 7.11984 5.50308 numMergedOcc 0
180 mol 282 unq 0 iso 0 dist 6.85028 5.39891 7.32347 7.76539 8.3411 10.5372 7.80785 6.8972 6.6348 6.3458 numMergedOcc 0
181 mol 282 unq 0 iso 1 dist 6.85028 7.76539 8.3411 5.39891 7.32347 10.5372 7.80785 6.8972 6.3458 6.6348 numMergedOcc 0
182 mol 282 unq 0 iso 2 dist 7.32347 5.39891 6.85028 10.5372 8.3411 7.76539 6.6348 6.8972 7.80785 6.3458 numMergedOcc 0
183 mol 282 unq 0 iso 3 dist 7.32347 10.5372 8.3411 5.39891 6.85028 7.76539 6.6348 6.8972 6.3458 7.80785 numMergedOcc 0
184 mol 282 unq 0 iso 4 dist 8.3411 7.76539 6.85028 10.5372 7.32347 5.39891 6.3458 6.8972 7.80785 6.6348 numMergedOcc 0
185 mol 282 unq 0 iso 5 dist 8.3411 10.5372 7.32347 7.76539 6.85028 5.39891 6.3458 6.8972 6.6348 7.80785 numMergedOcc 0
